Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:56:55 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./LiCuO2.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 25 25 7 997 997 155 Max 26 26 8 1003 1003 160 Sum 911 911 267 35951 35951 5649 bravais-lattice index = 14 lattice parameter (alat) = 5.9947 a.u. unit-cell volume = 254.1784 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 26.00 number of Kohn-Sham states= 34 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 412.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.994680 celldm(2)= 1.000000 celldm(3)= 1.771574 celldm(4)= 0.460568 celldm(5)= 0.460568 celldm(6)= 0.633050 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.633050 0.774111 0.000000 ) a(3) = ( 0.815931 0.386774 1.524184 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.817777 -0.327806 ) b(2) = ( 0.000000 1.291805 -0.327806 ) b(3) = ( 0.000000 0.000000 0.656089 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Li read from file: /users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Li 3.00 6.94100 Li( 1.00) Cu 11.00 63.54600 Cu( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 529 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018904 k( 2) = ( 0.0078125 0.0037033 -0.0051220), wk = 0.0018904 k( 3) = ( 0.0156250 0.0074067 -0.0102439), wk = 0.0018904 k( 4) = ( 0.0234375 0.0111100 -0.0153659), wk = 0.0018904 k( 5) = ( 0.0312500 0.0148134 -0.0204879), wk = 0.0018904 k( 6) = ( 0.0390625 0.0185167 -0.0256098), wk = 0.0018904 k( 7) = ( 0.0468750 0.0222200 -0.0307318), wk = 0.0018904 k( 8) = ( 0.0546875 0.0259234 -0.0358538), wk = 0.0018904 k( 9) = ( 0.0625000 0.0296267 -0.0409757), wk = 0.0018904 k( 10) = ( 0.0703125 0.0333301 -0.0460977), wk = 0.0018904 k( 11) = ( 0.0781250 0.0370334 -0.0512196), wk = 0.0018904 k( 12) = ( 0.0859375 0.0407367 -0.0563416), wk = 0.0018904 k( 13) = ( 0.0937500 0.0444401 -0.0614636), wk = 0.0018904 k( 14) = ( 0.1015625 0.0481434 -0.0665855), wk = 0.0018904 k( 15) = ( 0.1093750 0.0518468 -0.0717075), wk = 0.0018904 k( 16) = ( 0.1171875 0.0555501 -0.0768295), wk = 0.0018904 k( 17) = ( 0.1250000 0.0592534 -0.0819514), wk = 0.0018904 k( 18) = ( 0.1328125 0.0629568 -0.0870734), wk = 0.0018904 k( 19) = ( 0.1406250 0.0666601 -0.0921954), wk = 0.0018904 k( 20) = ( 0.1484375 0.0703635 -0.0973173), wk = 0.0018904 k( 21) = ( 0.1562500 0.0740668 -0.1024393), wk = 0.0018904 k( 22) = ( 0.1640625 0.0777701 -0.1075613), wk = 0.0018904 k( 23) = ( 0.1718750 0.0814735 -0.1126832), wk = 0.0018904 k( 24) = ( 0.1796875 0.0851768 -0.1178052), wk = 0.0018904 k( 25) = ( 0.1875000 0.0888802 -0.1229272), wk = 0.0018904 k( 26) = ( 0.1953125 0.0925835 -0.1280491), wk = 0.0018904 k( 27) = ( 0.2031250 0.0962868 -0.1331711), wk = 0.0018904 k( 28) = ( 0.2109375 0.0999902 -0.1382931), wk = 0.0018904 k( 29) = ( 0.2187500 0.1036935 -0.1434150), wk = 0.0018904 k( 30) = ( 0.2265625 0.1073969 -0.1485370), wk = 0.0018904 k( 31) = ( 0.2343750 0.1111002 -0.1536589), wk = 0.0018904 k( 32) = ( 0.2421875 0.1148035 -0.1587809), wk = 0.0018904 k( 33) = ( 0.2500000 0.1185069 -0.1639029), wk = 0.0018904 k( 34) = ( 0.2578125 0.1222102 -0.1690248), wk = 0.0018904 k( 35) = ( 0.2656250 0.1259136 -0.1741468), wk = 0.0018904 k( 36) = ( 0.2734375 0.1296169 -0.1792688), wk = 0.0018904 k( 37) = ( 0.2812500 0.1333203 -0.1843907), wk = 0.0018904 k( 38) = ( 0.2890625 0.1370236 -0.1895127), wk = 0.0018904 k( 39) = ( 0.2968750 0.1407269 -0.1946347), wk = 0.0018904 k( 40) = ( 0.3046875 0.1444303 -0.1997566), wk = 0.0018904 k( 41) = ( 0.3125000 0.1481336 -0.2048786), wk = 0.0018904 k( 42) = ( 0.3203125 0.1518370 -0.2100006), wk = 0.0018904 k( 43) = ( 0.3281250 0.1555403 -0.2151225), wk = 0.0018904 k( 44) = ( 0.3359375 0.1592436 -0.2202445), wk = 0.0018904 k( 45) = ( 0.3437500 0.1629470 -0.2253665), wk = 0.0018904 k( 46) = ( 0.3515625 0.1666503 -0.2304884), wk = 0.0018904 k( 47) = ( 0.3593750 0.1703537 -0.2356104), wk = 0.0018904 k( 48) = ( 0.3671875 0.1740570 -0.2407323), wk = 0.0018904 k( 49) = ( 0.3750000 0.1777603 -0.2458543), wk = 0.0018904 k( 50) = ( 0.3828125 0.1814637 -0.2509763), wk = 0.0018904 k( 51) = ( 0.3906250 0.1851670 -0.2560982), wk = 0.0018904 k( 52) = ( 0.3984375 0.1888704 -0.2612202), wk = 0.0018904 k( 53) = ( 0.4062500 0.1925737 -0.2663422), wk = 0.0018904 k( 54) = ( 0.4140625 0.1962770 -0.2714641), wk = 0.0018904 k( 55) = ( 0.4218750 0.1999804 -0.2765861), wk = 0.0018904 k( 56) = ( 0.4296875 0.2036837 -0.2817081), wk = 0.0018904 k( 57) = ( 0.4375000 0.2073871 -0.2868300), wk = 0.0018904 k( 58) = ( 0.4453125 0.2110904 -0.2919520), wk = 0.0018904 k( 59) = ( 0.4531250 0.2147937 -0.2970740), wk = 0.0018904 k( 60) = ( 0.4609375 0.2184971 -0.3021959), wk = 0.0018904 k( 61) = ( 0.4687500 0.2222004 -0.3073179), wk = 0.0018904 k( 62) = ( 0.4765625 0.2259038 -0.3124399), wk = 0.0018904 k( 63) = ( 0.4843750 0.2296071 -0.3175618), wk = 0.0018904 k( 64) = ( 0.4921875 0.2333104 -0.3226838), wk = 0.0018904 k( 65) = ( 0.5000000 0.2370138 -0.3278057), wk = 0.0018904 k( 66) = ( 0.5000000 0.2370138 -0.3278057), wk = 0.0018904 k( 67) = ( 0.5001277 0.2370743 -0.3275672), wk = 0.0018904 k( 68) = ( 0.5001277 0.2370743 -0.3275672), wk = 0.0018904 k( 69) = ( 0.5001238 0.2370725 -0.3176337), wk = 0.0018904 k( 70) = ( 0.5001200 0.2370706 -0.3077002), wk = 0.0018904 k( 71) = ( 0.5001161 0.2370688 -0.2977666), wk = 0.0018904 k( 72) = ( 0.5001122 0.2370670 -0.2878331), wk = 0.0018904 k( 73) = ( 0.5001084 0.2370651 -0.2778996), wk = 0.0018904 k( 74) = ( 0.5001045 0.2370633 -0.2679661), wk = 0.0018904 k( 75) = ( 0.5001006 0.2370615 -0.2580326), wk = 0.0018904 k( 76) = ( 0.5000967 0.2370596 -0.2480991), wk = 0.0018904 k( 77) = ( 0.5000929 0.2370578 -0.2381656), wk = 0.0018904 k( 78) = ( 0.5000890 0.2370560 -0.2282321), wk = 0.0018904 k( 79) = ( 0.5000851 0.2370541 -0.2182986), wk = 0.0018904 k( 80) = ( 0.5000813 0.2370523 -0.2083651), wk = 0.0018904 k( 81) = ( 0.5000774 0.2370505 -0.1984316), wk = 0.0018904 k( 82) = ( 0.5000735 0.2370486 -0.1884981), wk = 0.0018904 k( 83) = ( 0.5000697 0.2370468 -0.1785646), wk = 0.0018904 k( 84) = ( 0.5000658 0.2370450 -0.1686311), wk = 0.0018904 k( 85) = ( 0.5000619 0.2370431 -0.1586975), wk = 0.0018904 k( 86) = ( 0.5000581 0.2370413 -0.1487640), wk = 0.0018904 k( 87) = ( 0.5000542 0.2370395 -0.1388305), wk = 0.0018904 k( 88) = ( 0.5000503 0.2370376 -0.1288970), wk = 0.0018904 k( 89) = ( 0.5000464 0.2370358 -0.1189635), wk = 0.0018904 k( 90) = ( 0.5000426 0.2370340 -0.1090300), wk = 0.0018904 k( 91) = ( 0.5000387 0.2370321 -0.0990965), wk = 0.0018904 k( 92) = ( 0.5000348 0.2370303 -0.0891630), wk = 0.0018904 k( 93) = ( 0.5000310 0.2370285 -0.0792295), wk = 0.0018904 k( 94) = ( 0.5000271 0.2370266 -0.0692960), wk = 0.0018904 k( 95) = ( 0.5000232 0.2370248 -0.0593625), wk = 0.0018904 k( 96) = ( 0.5000193 0.2370230 -0.0494290), wk = 0.0018904 k( 97) = ( 0.5000155 0.2370211 -0.0394955), wk = 0.0018904 k( 98) = ( 0.5000116 0.2370193 -0.0295620), wk = 0.0018904 k( 99) = ( 0.5000077 0.2370174 -0.0196284), wk = 0.0018904 k( 100) = ( 0.5000039 0.2370156 -0.0096949), wk = 0.0018904 k( 101) = ( 0.5000000 0.2370138 0.0002386), wk = 0.0018904 k( 102) = ( 0.5000000 0.2370138 0.0002386), wk = 0.0018904 k( 103) = ( 0.5042714 0.2280030 0.0002386), wk = 0.0018904 k( 104) = ( 0.5085428 0.2189921 0.0002386), wk = 0.0018904 k( 105) = ( 0.5128141 0.2099813 0.0002386), wk = 0.0018904 k( 106) = ( 0.5170855 0.2009705 0.0002386), wk = 0.0018904 k( 107) = ( 0.5213569 0.1919597 0.0002386), wk = 0.0018904 k( 108) = ( 0.5256283 0.1829489 0.0002386), wk = 0.0018904 k( 109) = ( 0.5298996 0.1739381 0.0002386), wk = 0.0018904 k( 110) = ( 0.5341710 0.1649273 0.0002386), wk = 0.0018904 k( 111) = ( 0.5384424 0.1559164 0.0002386), wk = 0.0018904 k( 112) = ( 0.5427137 0.1469056 0.0002386), wk = 0.0018904 k( 113) = ( 0.5469851 0.1378948 0.0002386), wk = 0.0018904 k( 114) = ( 0.5512565 0.1288840 0.0002386), wk = 0.0018904 k( 115) = ( 0.5555279 0.1198732 0.0002386), wk = 0.0018904 k( 116) = ( 0.5597992 0.1108624 0.0002386), wk = 0.0018904 k( 117) = ( 0.5640706 0.1018515 0.0002386), wk = 0.0018904 k( 118) = ( 0.5683420 0.0928407 0.0002386), wk = 0.0018904 k( 119) = ( 0.5726134 0.0838299 0.0002386), wk = 0.0018904 k( 120) = ( 0.5768847 0.0748191 0.0002386), wk = 0.0018904 k( 121) = ( 0.5811561 0.0658083 0.0002386), wk = 0.0018904 k( 122) = ( 0.5854275 0.0567975 0.0002386), wk = 0.0018904 k( 123) = ( 0.5896989 0.0477866 0.0002386), wk = 0.0018904 k( 124) = ( 0.5939703 0.0387758 0.0002386), wk = 0.0018904 k( 125) = ( 0.5982416 0.0297650 0.0002386), wk = 0.0018904 k( 126) = ( 0.6025130 0.0207542 0.0002386), wk = 0.0018904 k( 127) = ( 0.6067844 0.0117434 0.0002386), wk = 0.0018904 k( 128) = ( 0.6110558 0.0027326 0.0002386), wk = 0.0018904 k( 129) = ( 0.6153271 -0.0062783 0.0002386), wk = 0.0018904 k( 130) = ( 0.6195985 -0.0152891 0.0002386), wk = 0.0018904 k( 131) = ( 0.6238699 -0.0242999 0.0002386), wk = 0.0018904 k( 132) = ( 0.6281413 -0.0333107 0.0002386), wk = 0.0018904 k( 133) = ( 0.6324126 -0.0423215 0.0002386), wk = 0.0018904 k( 134) = ( 0.6366840 -0.0513323 0.0002386), wk = 0.0018904 k( 135) = ( 0.6409554 -0.0603432 0.0002386), wk = 0.0018904 k( 136) = ( 0.6452268 -0.0693540 0.0002386), wk = 0.0018904 k( 137) = ( 0.6494981 -0.0783648 0.0002386), wk = 0.0018904 k( 138) = ( 0.6537695 -0.0873756 0.0002386), wk = 0.0018904 k( 139) = ( 0.6580409 -0.0963864 0.0002386), wk = 0.0018904 k( 140) = ( 0.6623123 -0.1053972 0.0002386), wk = 0.0018904 k( 141) = ( 0.6665836 -0.1144080 0.0002386), wk = 0.0018904 k( 142) = ( 0.6708550 -0.1234189 0.0002386), wk = 0.0018904 k( 143) = ( 0.6751264 -0.1324297 0.0002386), wk = 0.0018904 k( 144) = ( 0.6793978 -0.1414405 0.0002386), wk = 0.0018904 k( 145) = ( 0.6836691 -0.1504513 0.0002386), wk = 0.0018904 k( 146) = ( 0.6879405 -0.1594621 0.0002386), wk = 0.0018904 k( 147) = ( 0.6922119 -0.1684729 0.0002386), wk = 0.0018904 k( 148) = ( 0.6964833 -0.1774838 0.0002386), wk = 0.0018904 k( 149) = ( 0.7007546 -0.1864946 0.0002386), wk = 0.0018904 k( 150) = ( 0.7050260 -0.1955054 0.0002386), wk = 0.0018904 k( 151) = ( 0.7092974 -0.2045162 0.0002386), wk = 0.0018904 k( 152) = ( 0.7135688 -0.2135270 0.0002386), wk = 0.0018904 k( 153) = ( 0.2864312 -0.6042502 0.3280443), wk = 0.0018904 k( 154) = ( 0.2821561 -0.5952315 0.3280443), wk = 0.0018904 k( 155) = ( 0.2778811 -0.5862129 0.3280443), wk = 0.0018904 k( 156) = ( 0.2736060 -0.5771942 0.3280443), wk = 0.0018904 k( 157) = ( 0.2693309 -0.5681756 0.3280443), wk = 0.0018904 k( 158) = ( 0.2650558 -0.5591569 0.3280443), wk = 0.0018904 k( 159) = ( 0.2607807 -0.5501382 0.3280443), wk = 0.0018904 k( 160) = ( 0.2565056 -0.5411196 0.3280443), wk = 0.0018904 k( 161) = ( 0.2522305 -0.5321009 0.3280443), wk = 0.0018904 k( 162) = ( 0.2479554 -0.5230822 0.3280443), wk = 0.0018904 k( 163) = ( 0.2436803 -0.5140636 0.3280443), wk = 0.0018904 k( 164) = ( 0.2394052 -0.5050449 0.3280443), wk = 0.0018904 k( 165) = ( 0.2351301 -0.4960263 0.3280443), wk = 0.0018904 k( 166) = ( 0.2308550 -0.4870076 0.3280443), wk = 0.0018904 k( 167) = ( 0.2265799 -0.4779890 0.3280443), wk = 0.0018904 k( 168) = ( 0.2223048 -0.4689703 0.3280443), wk = 0.0018904 k( 169) = ( 0.2180297 -0.4599516 0.3280443), wk = 0.0018904 k( 170) = ( 0.2137547 -0.4509330 0.3280443), wk = 0.0018904 k( 171) = ( 0.2094796 -0.4419143 0.3280443), wk = 0.0018904 k( 172) = ( 0.2052045 -0.4328957 0.3280443), wk = 0.0018904 k( 173) = ( 0.2009294 -0.4238770 0.3280443), wk = 0.0018904 k( 174) = ( 0.1966543 -0.4148583 0.3280443), wk = 0.0018904 k( 175) = ( 0.1923792 -0.4058397 0.3280443), wk = 0.0018904 k( 176) = ( 0.1881041 -0.3968210 0.3280443), wk = 0.0018904 k( 177) = ( 0.1838290 -0.3878024 0.3280443), wk = 0.0018904 k( 178) = ( 0.1795539 -0.3787837 0.3280443), wk = 0.0018904 k( 179) = ( 0.1752788 -0.3697650 0.3280443), wk = 0.0018904 k( 180) = ( 0.1710037 -0.3607464 0.3280443), wk = 0.0018904 k( 181) = ( 0.1667286 -0.3517277 0.3280443), wk = 0.0018904 k( 182) = ( 0.1624535 -0.3427091 0.3280443), wk = 0.0018904 k( 183) = ( 0.1581784 -0.3336904 0.3280443), wk = 0.0018904 k( 184) = ( 0.1539033 -0.3246717 0.3280443), wk = 0.0018904 k( 185) = ( 0.1496283 -0.3156531 0.3280443), wk = 0.0018904 k( 186) = ( 0.1453532 -0.3066344 0.3280443), wk = 0.0018904 k( 187) = ( 0.1410781 -0.2976158 0.3280443), wk = 0.0018904 k( 188) = ( 0.1368030 -0.2885971 0.3280443), wk = 0.0018904 k( 189) = ( 0.1325279 -0.2795784 0.3280443), wk = 0.0018904 k( 190) = ( 0.1282528 -0.2705598 0.3280443), wk = 0.0018904 k( 191) = ( 0.1239777 -0.2615411 0.3280443), wk = 0.0018904 k( 192) = ( 0.1197026 -0.2525225 0.3280443), wk = 0.0018904 k( 193) = ( 0.1154275 -0.2435038 0.3280443), wk = 0.0018904 k( 194) = ( 0.1111524 -0.2344851 0.3280443), wk = 0.0018904 k( 195) = ( 0.1068773 -0.2254665 0.3280443), wk = 0.0018904 k( 196) = ( 0.1026022 -0.2164478 0.3280443), wk = 0.0018904 k( 197) = ( 0.0983271 -0.2074292 0.3280443), wk = 0.0018904 k( 198) = ( 0.0940520 -0.1984105 0.3280443), wk = 0.0018904 k( 199) = ( 0.0897770 -0.1893919 0.3280443), wk = 0.0018904 k( 200) = ( 0.0855019 -0.1803732 0.3280443), wk = 0.0018904 k( 201) = ( 0.0812268 -0.1713545 0.3280443), wk = 0.0018904 k( 202) = ( 0.0769517 -0.1623359 0.3280443), wk = 0.0018904 k( 203) = ( 0.0726766 -0.1533172 0.3280443), wk = 0.0018904 k( 204) = ( 0.0684015 -0.1442986 0.3280443), wk = 0.0018904 k( 205) = ( 0.0641264 -0.1352799 0.3280443), wk = 0.0018904 k( 206) = ( 0.0598513 -0.1262612 0.3280443), wk = 0.0018904 k( 207) = ( 0.0555762 -0.1172426 0.3280443), wk = 0.0018904 k( 208) = ( 0.0513011 -0.1082239 0.3280443), wk = 0.0018904 k( 209) = ( 0.0470260 -0.0992052 0.3280443), wk = 0.0018904 k( 210) = ( 0.0427509 -0.0901866 0.3280443), wk = 0.0018904 k( 211) = ( 0.0384758 -0.0811679 0.3280443), wk = 0.0018904 k( 212) = ( 0.0342008 -0.0721493 0.3280443), wk = 0.0018904 k( 213) = ( 0.0299257 -0.0631306 0.3280443), wk = 0.0018904 k( 214) = ( 0.0256506 -0.0541120 0.3280443), wk = 0.0018904 k( 215) = ( 0.0213755 -0.0450933 0.3280443), wk = 0.0018904 k( 216) = ( 0.0171004 -0.0360746 0.3280443), wk = 0.0018904 k( 217) = ( 0.0128253 -0.0270560 0.3280443), wk = 0.0018904 k( 218) = ( 0.0085502 -0.0180373 0.3280443), wk = 0.0018904 k( 219) = ( 0.0042751 -0.0090187 0.3280443), wk = 0.0018904 k( 220) = ( 0.0000000 0.0000000 0.3280443), wk = 0.0018904 k( 221) = ( 0.0000000 0.0000000 0.3280443), wk = 0.0018904 k( 222) = ( 0.0090886 0.0043082 0.3280443), wk = 0.0018904 k( 223) = ( 0.0181772 0.0086165 0.3280443), wk = 0.0018904 k( 224) = ( 0.0272658 0.0129247 0.3280443), wk = 0.0018904 k( 225) = ( 0.0363544 0.0172330 0.3280443), wk = 0.0018904 k( 226) = ( 0.0454429 0.0215412 0.3280443), wk = 0.0018904 k( 227) = ( 0.0545315 0.0258494 0.3280443), wk = 0.0018904 k( 228) = ( 0.0636201 0.0301577 0.3280443), wk = 0.0018904 k( 229) = ( 0.0727087 0.0344659 0.3280443), wk = 0.0018904 k( 230) = ( 0.0817973 0.0387742 0.3280443), wk = 0.0018904 k( 231) = ( 0.0908859 0.0430824 0.3280443), wk = 0.0018904 k( 232) = ( 0.0999745 0.0473906 0.3280443), wk = 0.0018904 k( 233) = ( 0.1090630 0.0516989 0.3280443), wk = 0.0018904 k( 234) = ( 0.1181516 0.0560071 0.3280443), wk = 0.0018904 k( 235) = ( 0.1272402 0.0603154 0.3280443), wk = 0.0018904 k( 236) = ( 0.1363288 0.0646236 0.3280443), wk = 0.0018904 k( 237) = ( 0.1454174 0.0689319 0.3280443), wk = 0.0018904 k( 238) = ( 0.1545060 0.0732401 0.3280443), wk = 0.0018904 k( 239) = ( 0.1635946 0.0775483 0.3280443), wk = 0.0018904 k( 240) = ( 0.1726832 0.0818566 0.3280443), wk = 0.0018904 k( 241) = ( 0.1817717 0.0861648 0.3280443), wk = 0.0018904 k( 242) = ( 0.1908603 0.0904731 0.3280443), wk = 0.0018904 k( 243) = ( 0.1999489 0.0947813 0.3280443), wk = 0.0018904 k( 244) = ( 0.2090375 0.0990895 0.3280443), wk = 0.0018904 k( 245) = ( 0.2181261 0.1033978 0.3280443), wk = 0.0018904 k( 246) = ( 0.2272147 0.1077060 0.3280443), wk = 0.0018904 k( 247) = ( 0.2363033 0.1120143 0.3280443), wk = 0.0018904 k( 248) = ( 0.2453918 0.1163225 0.3280443), wk = 0.0018904 k( 249) = ( 0.2544804 0.1206307 0.3280443), wk = 0.0018904 k( 250) = ( 0.2635690 0.1249390 0.3280443), wk = 0.0018904 k( 251) = ( 0.2726576 0.1292472 0.3280443), wk = 0.0018904 k( 252) = ( 0.2817462 0.1335555 0.3280443), wk = 0.0018904 k( 253) = ( 0.2908348 0.1378637 0.3280443), wk = 0.0018904 k( 254) = ( 0.2999234 0.1421719 0.3280443), wk = 0.0018904 k( 255) = ( 0.3090120 0.1464802 0.3280443), wk = 0.0018904 k( 256) = ( 0.3181005 0.1507884 0.3280443), wk = 0.0018904 k( 257) = ( 0.3271891 0.1550967 0.3280443), wk = 0.0018904 k( 258) = ( 0.3362777 0.1594049 0.3280443), wk = 0.0018904 k( 259) = ( 0.3453663 0.1637131 0.3280443), wk = 0.0018904 k( 260) = ( 0.3544549 0.1680214 0.3280443), wk = 0.0018904 k( 261) = ( 0.3635435 0.1723296 0.3280443), wk = 0.0018904 k( 262) = ( 0.3726321 0.1766379 0.3280443), wk = 0.0018904 k( 263) = ( 0.3817206 0.1809461 0.3280443), wk = 0.0018904 k( 264) = ( 0.3908092 0.1852544 0.3280443), wk = 0.0018904 k( 265) = ( 0.3998978 0.1895626 0.3280443), wk = 0.0018904 k( 266) = ( 0.4089864 0.1938708 0.3280443), wk = 0.0018904 k( 267) = ( 0.4180750 0.1981791 0.3280443), wk = 0.0018904 k( 268) = ( 0.4271636 0.2024873 0.3280443), wk = 0.0018904 k( 269) = ( 0.4362522 0.2067956 0.3280443), wk = 0.0018904 k( 270) = ( 0.4453408 0.2111038 0.3280443), wk = 0.0018904 k( 271) = ( 0.4544294 0.2154120 0.3280443), wk = 0.0018904 k( 272) = ( 0.4635179 0.2197203 0.3280443), wk = 0.0018904 k( 273) = ( 0.4726065 0.2240285 0.3280443), wk = 0.0018904 k( 274) = ( 0.4816951 0.2283368 0.3280443), wk = 0.0018904 k( 275) = ( 0.4907837 0.2326450 0.3280443), wk = 0.0018904 k( 276) = ( 0.4998723 0.2369532 0.3280443), wk = 0.0018904 k( 277) = ( 0.5000000 0.2370138 -0.3278057), wk = 0.0018904 k( 278) = ( 0.5042466 0.2280553 -0.3278057), wk = 0.0018904 k( 279) = ( 0.5084931 0.2190968 -0.3278057), wk = 0.0018904 k( 280) = ( 0.5127397 0.2101384 -0.3278057), wk = 0.0018904 k( 281) = ( 0.5169862 0.2011799 -0.3278057), wk = 0.0018904 k( 282) = ( 0.5212328 0.1922215 -0.3278057), wk = 0.0018904 k( 283) = ( 0.5254794 0.1832630 -0.3278057), wk = 0.0018904 k( 284) = ( 0.5297259 0.1743045 -0.3278057), wk = 0.0018904 k( 285) = ( 0.5339725 0.1653461 -0.3278057), wk = 0.0018904 k( 286) = ( 0.5382190 0.1563876 -0.3278057), wk = 0.0018904 k( 287) = ( 0.5424656 0.1474292 -0.3278057), wk = 0.0018904 k( 288) = ( 0.5467121 0.1384707 -0.3278057), wk = 0.0018904 k( 289) = ( 0.5509587 0.1295122 -0.3278057), wk = 0.0018904 k( 290) = ( 0.5552052 0.1205538 -0.3278057), wk = 0.0018904 k( 291) = ( 0.5594518 0.1115953 -0.3278057), wk = 0.0018904 k( 292) = ( 0.5636984 0.1026368 -0.3278057), wk = 0.0018904 k( 293) = ( 0.5679449 0.0936784 -0.3278057), wk = 0.0018904 k( 294) = ( 0.5721915 0.0847199 -0.3278057), wk = 0.0018904 k( 295) = ( 0.5764380 0.0757615 -0.3278057), wk = 0.0018904 k( 296) = ( 0.5806846 0.0668030 -0.3278057), wk = 0.0018904 k( 297) = ( 0.5849312 0.0578445 -0.3278057), wk = 0.0018904 k( 298) = ( 0.5891777 0.0488861 -0.3278057), wk = 0.0018904 k( 299) = ( 0.5934243 0.0399276 -0.3278057), wk = 0.0018904 k( 300) = ( 0.5976708 0.0309692 -0.3278057), wk = 0.0018904 k( 301) = ( 0.6019174 0.0220107 -0.3278057), wk = 0.0018904 k( 302) = ( 0.6061640 0.0130522 -0.3278057), wk = 0.0018904 k( 303) = ( 0.6104105 0.0040938 -0.3278057), wk = 0.0018904 k( 304) = ( 0.6146571 -0.0048647 -0.3278057), wk = 0.0018904 k( 305) = ( 0.6189036 -0.0138232 -0.3278057), wk = 0.0018904 k( 306) = ( 0.6231502 -0.0227816 -0.3278057), wk = 0.0018904 k( 307) = ( 0.6273967 -0.0317401 -0.3278057), wk = 0.0018904 k( 308) = ( 0.6316433 -0.0406986 -0.3278057), wk = 0.0018904 k( 309) = ( 0.6358898 -0.0496570 -0.3278057), wk = 0.0018904 k( 310) = ( 0.6401364 -0.0586155 -0.3278057), wk = 0.0018904 k( 311) = ( 0.6443830 -0.0675739 -0.3278057), wk = 0.0018904 k( 312) = ( 0.6486295 -0.0765324 -0.3278057), wk = 0.0018904 k( 313) = ( 0.6528761 -0.0854909 -0.3278057), wk = 0.0018904 k( 314) = ( 0.6571226 -0.0944493 -0.3278057), wk = 0.0018904 k( 315) = ( 0.6613692 -0.1034078 -0.3278057), wk = 0.0018904 k( 316) = ( 0.6656158 -0.1123662 -0.3278057), wk = 0.0018904 k( 317) = ( 0.6698623 -0.1213247 -0.3278057), wk = 0.0018904 k( 318) = ( 0.6741089 -0.1302832 -0.3278057), wk = 0.0018904 k( 319) = ( 0.3258911 -0.6874940 0.0000000), wk = 0.0018904 k( 320) = ( 0.3216031 -0.6784481 -0.0000000), wk = 0.0018904 k( 321) = ( 0.3173150 -0.6694021 -0.0000000), wk = 0.0018904 k( 322) = ( 0.3130270 -0.6603561 0.0000000), wk = 0.0018904 k( 323) = ( 0.3087390 -0.6513101 0.0000000), wk = 0.0018904 k( 324) = ( 0.3044509 -0.6422642 -0.0000000), wk = 0.0018904 k( 325) = ( 0.3001629 -0.6332182 -0.0000000), wk = 0.0018904 k( 326) = ( 0.2958748 -0.6241722 0.0000000), wk = 0.0018904 k( 327) = ( 0.2915868 -0.6151263 -0.0000000), wk = 0.0018904 k( 328) = ( 0.2872987 -0.6060803 -0.0000000), wk = 0.0018904 k( 329) = ( 0.2830107 -0.5970343 -0.0000000), wk = 0.0018904 k( 330) = ( 0.2787227 -0.5879883 0.0000000), wk = 0.0018904 k( 331) = ( 0.2744346 -0.5789424 0.0000000), wk = 0.0018904 k( 332) = ( 0.2701466 -0.5698964 -0.0000000), wk = 0.0018904 k( 333) = ( 0.2658586 -0.5608504 -0.0000000), wk = 0.0018904 k( 334) = ( 0.2615705 -0.5518044 0.0000000), wk = 0.0018904 k( 335) = ( 0.2572825 -0.5427585 -0.0000000), wk = 0.0018904 k( 336) = ( 0.2529944 -0.5337125 -0.0000000), wk = 0.0018904 k( 337) = ( 0.2487064 -0.5246665 -0.0000000), wk = 0.0018904 k( 338) = ( 0.2444183 -0.5156205 0.0000000), wk = 0.0018904 k( 339) = ( 0.2401303 -0.5065746 0.0000000), wk = 0.0018904 k( 340) = ( 0.2358423 -0.4975286 0.0000000), wk = 0.0018904 k( 341) = ( 0.2315542 -0.4884826 -0.0000000), wk = 0.0018904 k( 342) = ( 0.2272662 -0.4794366 -0.0000000), wk = 0.0018904 k( 343) = ( 0.2229781 -0.4703907 -0.0000000), wk = 0.0018904 k( 344) = ( 0.2186901 -0.4613447 -0.0000000), wk = 0.0018904 k( 345) = ( 0.2144021 -0.4522987 0.0000000), wk = 0.0018904 k( 346) = ( 0.2101140 -0.4432527 -0.0000000), wk = 0.0018904 k( 347) = ( 0.2058260 -0.4342068 0.0000000), wk = 0.0018904 k( 348) = ( 0.2015379 -0.4251608 0.0000000), wk = 0.0018904 k( 349) = ( 0.1972499 -0.4161148 -0.0000000), wk = 0.0018904 k( 350) = ( 0.1929618 -0.4070688 0.0000000), wk = 0.0018904 k( 351) = ( 0.1886738 -0.3980229 0.0000000), wk = 0.0018904 k( 352) = ( 0.1843858 -0.3889769 -0.0000000), wk = 0.0018904 k( 353) = ( 0.1800977 -0.3799309 0.0000000), wk = 0.0018904 k( 354) = ( 0.1758097 -0.3708850 0.0000000), wk = 0.0018904 k( 355) = ( 0.1715216 -0.3618390 0.0000000), wk = 0.0018904 k( 356) = ( 0.1672336 -0.3527930 -0.0000000), wk = 0.0018904 k( 357) = ( 0.1629456 -0.3437470 0.0000000), wk = 0.0018904 k( 358) = ( 0.1586575 -0.3347010 -0.0000000), wk = 0.0018904 k( 359) = ( 0.1543695 -0.3256551 0.0000000), wk = 0.0018904 k( 360) = ( 0.1500814 -0.3166091 -0.0000000), wk = 0.0018904 k( 361) = ( 0.1457934 -0.3075631 -0.0000000), wk = 0.0018904 k( 362) = ( 0.1415054 -0.2985172 0.0000000), wk = 0.0018904 k( 363) = ( 0.1372173 -0.2894712 -0.0000000), wk = 0.0018904 k( 364) = ( 0.1329293 -0.2804252 -0.0000000), wk = 0.0018904 k( 365) = ( 0.1286412 -0.2713792 0.0000000), wk = 0.0018904 k( 366) = ( 0.1243532 -0.2623332 -0.0000000), wk = 0.0018904 k( 367) = ( 0.1200651 -0.2532873 0.0000000), wk = 0.0018904 k( 368) = ( 0.1157771 -0.2442413 -0.0000000), wk = 0.0018904 k( 369) = ( 0.1114891 -0.2351953 -0.0000000), wk = 0.0018904 k( 370) = ( 0.1072010 -0.2261494 0.0000000), wk = 0.0018904 k( 371) = ( 0.1029130 -0.2171034 0.0000000), wk = 0.0018904 k( 372) = ( 0.0986250 -0.2080574 -0.0000000), wk = 0.0018904 k( 373) = ( 0.0943369 -0.1990114 -0.0000000), wk = 0.0018904 k( 374) = ( 0.0900489 -0.1899655 0.0000000), wk = 0.0018904 k( 375) = ( 0.0857608 -0.1809195 0.0000000), wk = 0.0018904 k( 376) = ( 0.0814728 -0.1718735 0.0000000), wk = 0.0018904 k( 377) = ( 0.0771847 -0.1628275 0.0000000), wk = 0.0018904 k( 378) = ( 0.0728967 -0.1537816 -0.0000000), wk = 0.0018904 k( 379) = ( 0.0686087 -0.1447356 -0.0000000), wk = 0.0018904 k( 380) = ( 0.0643206 -0.1356896 0.0000000), wk = 0.0018904 k( 381) = ( 0.0600326 -0.1266436 0.0000000), wk = 0.0018904 k( 382) = ( 0.0557445 -0.1175977 0.0000000), wk = 0.0018904 k( 383) = ( 0.0514565 -0.1085517 -0.0000000), wk = 0.0018904 k( 384) = ( 0.0471685 -0.0995057 -0.0000000), wk = 0.0018904 k( 385) = ( 0.0428804 -0.0904597 0.0000000), wk = 0.0018904 k( 386) = ( 0.0385924 -0.0814138 0.0000000), wk = 0.0018904 k( 387) = ( 0.0343043 -0.0723678 -0.0000000), wk = 0.0018904 k( 388) = ( 0.0300163 -0.0633218 0.0000000), wk = 0.0018904 k( 389) = ( 0.0257283 -0.0542759 0.0000000), wk = 0.0018904 k( 390) = ( 0.0214402 -0.0452299 0.0000000), wk = 0.0018904 k( 391) = ( 0.0171522 -0.0361839 0.0000000), wk = 0.0018904 k( 392) = ( 0.0128641 -0.0271379 0.0000000), wk = 0.0018904 k( 393) = ( 0.0085761 -0.0180919 0.0000000), wk = 0.0018904 k( 394) = ( 0.0042880 -0.0090460 0.0000000), wk = 0.0018904 k( 395) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018904 k( 396) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018904 k( 397) = ( 0.0075758 -0.0061953 -0.0024834), wk = 0.0018904 k( 398) = ( 0.0151515 -0.0123906 -0.0049668), wk = 0.0018904 k( 399) = ( 0.0227273 -0.0185858 -0.0074501), wk = 0.0018904 k( 400) = ( 0.0303030 -0.0247811 -0.0099335), wk = 0.0018904 k( 401) = ( 0.0378788 -0.0309764 -0.0124169), wk = 0.0018904 k( 402) = ( 0.0454546 -0.0371717 -0.0149003), wk = 0.0018904 k( 403) = ( 0.0530303 -0.0433670 -0.0173836), wk = 0.0018904 k( 404) = ( 0.0606061 -0.0495623 -0.0198670), wk = 0.0018904 k( 405) = ( 0.0681818 -0.0557575 -0.0223504), wk = 0.0018904 k( 406) = ( 0.0757576 -0.0619528 -0.0248338), wk = 0.0018904 k( 407) = ( 0.0833333 -0.0681481 -0.0273171), wk = 0.0018904 k( 408) = ( 0.0909091 -0.0743434 -0.0298005), wk = 0.0018904 k( 409) = ( 0.0984848 -0.0805387 -0.0322839), wk = 0.0018904 k( 410) = ( 0.1060606 -0.0867339 -0.0347673), wk = 0.0018904 k( 411) = ( 0.1136364 -0.0929292 -0.0372507), wk = 0.0018904 k( 412) = ( 0.1212121 -0.0991245 -0.0397340), wk = 0.0018904 k( 413) = ( 0.1287879 -0.1053198 -0.0422174), wk = 0.0018904 k( 414) = ( 0.1363636 -0.1115151 -0.0447008), wk = 0.0018904 k( 415) = ( 0.1439394 -0.1177104 -0.0471842), wk = 0.0018904 k( 416) = ( 0.1515151 -0.1239056 -0.0496675), wk = 0.0018904 k( 417) = ( 0.1590909 -0.1301009 -0.0521509), wk = 0.0018904 k( 418) = ( 0.1666667 -0.1362962 -0.0546343), wk = 0.0018904 k( 419) = ( 0.1742424 -0.1424915 -0.0571177), wk = 0.0018904 k( 420) = ( 0.1818182 -0.1486868 -0.0596010), wk = 0.0018904 k( 421) = ( 0.1893939 -0.1548820 -0.0620844), wk = 0.0018904 k( 422) = ( 0.1969697 -0.1610773 -0.0645678), wk = 0.0018904 k( 423) = ( 0.2045454 -0.1672726 -0.0670512), wk = 0.0018904 k( 424) = ( 0.2121212 -0.1734679 -0.0695346), wk = 0.0018904 k( 425) = ( 0.2196970 -0.1796632 -0.0720179), wk = 0.0018904 k( 426) = ( 0.2272727 -0.1858585 -0.0745013), wk = 0.0018904 k( 427) = ( 0.2348485 -0.1920537 -0.0769847), wk = 0.0018904 k( 428) = ( 0.2424242 -0.1982490 -0.0794681), wk = 0.0018904 k( 429) = ( 0.2500000 -0.2044443 -0.0819514), wk = 0.0018904 k( 430) = ( 0.2575758 -0.2106396 -0.0844348), wk = 0.0018904 k( 431) = ( 0.2651515 -0.2168349 -0.0869182), wk = 0.0018904 k( 432) = ( 0.2727273 -0.2230301 -0.0894016), wk = 0.0018904 k( 433) = ( 0.2803030 -0.2292254 -0.0918849), wk = 0.0018904 k( 434) = ( 0.2878788 -0.2354207 -0.0943683), wk = 0.0018904 k( 435) = ( 0.2954545 -0.2416160 -0.0968517), wk = 0.0018904 k( 436) = ( 0.3030303 -0.2478113 -0.0993351), wk = 0.0018904 k( 437) = ( 0.3106061 -0.2540066 -0.1018185), wk = 0.0018904 k( 438) = ( 0.3181818 -0.2602018 -0.1043018), wk = 0.0018904 k( 439) = ( 0.3257576 -0.2663971 -0.1067852), wk = 0.0018904 k( 440) = ( 0.3333333 -0.2725924 -0.1092686), wk = 0.0018904 k( 441) = ( 0.3409091 -0.2787877 -0.1117520), wk = 0.0018904 k( 442) = ( 0.3484849 -0.2849830 -0.1142353), wk = 0.0018904 k( 443) = ( 0.3560606 -0.2911783 -0.1167187), wk = 0.0018904 k( 444) = ( 0.3636364 -0.2973735 -0.1192021), wk = 0.0018904 k( 445) = ( 0.3712121 -0.3035688 -0.1216855), wk = 0.0018904 k( 446) = ( 0.3787879 -0.3097641 -0.1241688), wk = 0.0018904 k( 447) = ( 0.3863636 -0.3159594 -0.1266522), wk = 0.0018904 k( 448) = ( 0.3939394 -0.3221547 -0.1291356), wk = 0.0018904 k( 449) = ( 0.4015151 -0.3283499 -0.1316190), wk = 0.0018904 k( 450) = ( 0.4090909 -0.3345452 -0.1341024), wk = 0.0018904 k( 451) = ( 0.4166667 -0.3407405 -0.1365857), wk = 0.0018904 k( 452) = ( 0.4242424 -0.3469358 -0.1390691), wk = 0.0018904 k( 453) = ( 0.4318182 -0.3531311 -0.1415525), wk = 0.0018904 k( 454) = ( 0.4393939 -0.3593264 -0.1440359), wk = 0.0018904 k( 455) = ( 0.4469697 -0.3655216 -0.1465192), wk = 0.0018904 k( 456) = ( 0.4545455 -0.3717169 -0.1490026), wk = 0.0018904 k( 457) = ( 0.4621212 -0.3779122 -0.1514860), wk = 0.0018904 k( 458) = ( 0.4696970 -0.3841075 -0.1539694), wk = 0.0018904 k( 459) = ( 0.4772727 -0.3903028 -0.1564527), wk = 0.0018904 k( 460) = ( 0.4848485 -0.3964980 -0.1589361), wk = 0.0018904 k( 461) = ( 0.4924242 -0.4026933 -0.1614195), wk = 0.0018904 k( 462) = ( 0.5000000 -0.4088886 -0.1639029), wk = 0.0018904 k( 463) = ( 0.5000000 -0.4088886 0.1641414), wk = 0.0018904 k( 464) = ( 0.4924242 -0.4026933 0.1616545), wk = 0.0018904 k( 465) = ( 0.4848485 -0.3964980 0.1591675), wk = 0.0018904 k( 466) = ( 0.4772727 -0.3903028 0.1566805), wk = 0.0018904 k( 467) = ( 0.4696970 -0.3841075 0.1541935), wk = 0.0018904 k( 468) = ( 0.4621212 -0.3779122 0.1517065), wk = 0.0018904 k( 469) = ( 0.4545455 -0.3717169 0.1492195), wk = 0.0018904 k( 470) = ( 0.4469697 -0.3655216 0.1467325), wk = 0.0018904 k( 471) = ( 0.4393939 -0.3593264 0.1442455), wk = 0.0018904 k( 472) = ( 0.4318182 -0.3531311 0.1417585), wk = 0.0018904 k( 473) = ( 0.4242424 -0.3469358 0.1392715), wk = 0.0018904 k( 474) = ( 0.4166667 -0.3407405 0.1367845), wk = 0.0018904 k( 475) = ( 0.4090909 -0.3345452 0.1342975), wk = 0.0018904 k( 476) = ( 0.4015151 -0.3283499 0.1318106), wk = 0.0018904 k( 477) = ( 0.3939394 -0.3221547 0.1293236), wk = 0.0018904 k( 478) = ( 0.3863636 -0.3159594 0.1268366), wk = 0.0018904 k( 479) = ( 0.3787879 -0.3097641 0.1243496), wk = 0.0018904 k( 480) = ( 0.3712121 -0.3035688 0.1218626), wk = 0.0018904 k( 481) = ( 0.3636364 -0.2973735 0.1193756), wk = 0.0018904 k( 482) = ( 0.3560606 -0.2911783 0.1168886), wk = 0.0018904 k( 483) = ( 0.3484849 -0.2849830 0.1144016), wk = 0.0018904 k( 484) = ( 0.3409091 -0.2787877 0.1119146), wk = 0.0018904 k( 485) = ( 0.3333333 -0.2725924 0.1094276), wk = 0.0018904 k( 486) = ( 0.3257576 -0.2663971 0.1069406), wk = 0.0018904 k( 487) = ( 0.3181818 -0.2602018 0.1044536), wk = 0.0018904 k( 488) = ( 0.3106061 -0.2540066 0.1019667), wk = 0.0018904 k( 489) = ( 0.3030303 -0.2478113 0.0994797), wk = 0.0018904 k( 490) = ( 0.2954545 -0.2416160 0.0969927), wk = 0.0018904 k( 491) = ( 0.2878788 -0.2354207 0.0945057), wk = 0.0018904 k( 492) = ( 0.2803030 -0.2292254 0.0920187), wk = 0.0018904 k( 493) = ( 0.2727273 -0.2230301 0.0895317), wk = 0.0018904 k( 494) = ( 0.2651515 -0.2168349 0.0870447), wk = 0.0018904 k( 495) = ( 0.2575758 -0.2106396 0.0845577), wk = 0.0018904 k( 496) = ( 0.2500000 -0.2044443 0.0820707), wk = 0.0018904 k( 497) = ( 0.2424242 -0.1982490 0.0795837), wk = 0.0018904 k( 498) = ( 0.2348485 -0.1920537 0.0770967), wk = 0.0018904 k( 499) = ( 0.2272727 -0.1858585 0.0746098), wk = 0.0018904 k( 500) = ( 0.2196970 -0.1796632 0.0721228), wk = 0.0018904 k( 501) = ( 0.2121212 -0.1734679 0.0696358), wk = 0.0018904 k( 502) = ( 0.2045454 -0.1672726 0.0671488), wk = 0.0018904 k( 503) = ( 0.1969697 -0.1610773 0.0646618), wk = 0.0018904 k( 504) = ( 0.1893939 -0.1548820 0.0621748), wk = 0.0018904 k( 505) = ( 0.1818182 -0.1486868 0.0596878), wk = 0.0018904 k( 506) = ( 0.1742424 -0.1424915 0.0572008), wk = 0.0018904 k( 507) = ( 0.1666667 -0.1362962 0.0547138), wk = 0.0018904 k( 508) = ( 0.1590909 -0.1301009 0.0522268), wk = 0.0018904 k( 509) = ( 0.1515151 -0.1239056 0.0497398), wk = 0.0018904 k( 510) = ( 0.1439394 -0.1177104 0.0472528), wk = 0.0018904 k( 511) = ( 0.1363636 -0.1115151 0.0447659), wk = 0.0018904 k( 512) = ( 0.1287879 -0.1053198 0.0422789), wk = 0.0018904 k( 513) = ( 0.1212121 -0.0991245 0.0397919), wk = 0.0018904 k( 514) = ( 0.1136364 -0.0929292 0.0373049), wk = 0.0018904 k( 515) = ( 0.1060606 -0.0867339 0.0348179), wk = 0.0018904 k( 516) = ( 0.0984848 -0.0805387 0.0323309), wk = 0.0018904 k( 517) = ( 0.0909091 -0.0743434 0.0298439), wk = 0.0018904 k( 518) = ( 0.0833333 -0.0681481 0.0273569), wk = 0.0018904 k( 519) = ( 0.0757576 -0.0619528 0.0248699), wk = 0.0018904 k( 520) = ( 0.0681818 -0.0557575 0.0223829), wk = 0.0018904 k( 521) = ( 0.0606061 -0.0495623 0.0198959), wk = 0.0018904 k( 522) = ( 0.0530303 -0.0433670 0.0174089), wk = 0.0018904 k( 523) = ( 0.0454546 -0.0371717 0.0149220), wk = 0.0018904 k( 524) = ( 0.0378788 -0.0309764 0.0124350), wk = 0.0018904 k( 525) = ( 0.0303030 -0.0247811 0.0099480), wk = 0.0018904 k( 526) = ( 0.0227273 -0.0185858 0.0074610), wk = 0.0018904 k( 527) = ( 0.0151515 -0.0123906 0.0049740), wk = 0.0018904 k( 528) = ( 0.0075758 -0.0061953 0.0024870), wk = 0.0018904 k( 529) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018904 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018904 k( 2) = ( 0.0078125 0.0078125 0.0000000), wk = 0.0018904 k( 3) = ( 0.0156250 0.0156250 0.0000000), wk = 0.0018904 k( 4) = ( 0.0234375 0.0234375 0.0000000), wk = 0.0018904 k( 5) = ( 0.0312500 0.0312500 0.0000000), wk = 0.0018904 k( 6) = ( 0.0390625 0.0390625 0.0000000), wk = 0.0018904 k( 7) = ( 0.0468750 0.0468750 0.0000000), wk = 0.0018904 k( 8) = ( 0.0546875 0.0546875 0.0000000), wk = 0.0018904 k( 9) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0018904 k( 10) = ( 0.0703125 0.0703125 0.0000000), wk = 0.0018904 k( 11) = ( 0.0781250 0.0781250 0.0000000), wk = 0.0018904 k( 12) = ( 0.0859375 0.0859375 0.0000000), wk = 0.0018904 k( 13) = ( 0.0937500 0.0937500 0.0000000), wk = 0.0018904 k( 14) = ( 0.1015625 0.1015625 0.0000000), wk = 0.0018904 k( 15) = ( 0.1093750 0.1093750 0.0000000), wk = 0.0018904 k( 16) = ( 0.1171875 0.1171875 0.0000000), wk = 0.0018904 k( 17) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0018904 k( 18) = ( 0.1328125 0.1328125 0.0000000), wk = 0.0018904 k( 19) = ( 0.1406250 0.1406250 0.0000000), wk = 0.0018904 k( 20) = ( 0.1484375 0.1484375 0.0000000), wk = 0.0018904 k( 21) = ( 0.1562500 0.1562500 0.0000000), wk = 0.0018904 k( 22) = ( 0.1640625 0.1640625 0.0000000), wk = 0.0018904 k( 23) = ( 0.1718750 0.1718750 0.0000000), wk = 0.0018904 k( 24) = ( 0.1796875 0.1796875 0.0000000), wk = 0.0018904 k( 25) = ( 0.1875000 0.1875000 0.0000000), wk = 0.0018904 k( 26) = ( 0.1953125 0.1953125 0.0000000), wk = 0.0018904 k( 27) = ( 0.2031250 0.2031250 0.0000000), wk = 0.0018904 k( 28) = ( 0.2109375 0.2109375 0.0000000), wk = 0.0018904 k( 29) = ( 0.2187500 0.2187500 0.0000000), wk = 0.0018904 k( 30) = ( 0.2265625 0.2265625 0.0000000), wk = 0.0018904 k( 31) = ( 0.2343750 0.2343750 0.0000000), wk = 0.0018904 k( 32) = ( 0.2421875 0.2421875 0.0000000), wk = 0.0018904 k( 33) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0018904 k( 34) = ( 0.2578125 0.2578125 0.0000000), wk = 0.0018904 k( 35) = ( 0.2656250 0.2656250 0.0000000), wk = 0.0018904 k( 36) = ( 0.2734375 0.2734375 0.0000000), wk = 0.0018904 k( 37) = ( 0.2812500 0.2812500 0.0000000), wk = 0.0018904 k( 38) = ( 0.2890625 0.2890625 0.0000000), wk = 0.0018904 k( 39) = ( 0.2968750 0.2968750 0.0000000), wk = 0.0018904 k( 40) = ( 0.3046875 0.3046875 0.0000000), wk = 0.0018904 k( 41) = ( 0.3125000 0.3125000 0.0000000), wk = 0.0018904 k( 42) = ( 0.3203125 0.3203125 0.0000000), wk = 0.0018904 k( 43) = ( 0.3281250 0.3281250 0.0000000), wk = 0.0018904 k( 44) = ( 0.3359375 0.3359375 0.0000000), wk = 0.0018904 k( 45) = ( 0.3437500 0.3437500 0.0000000), wk = 0.0018904 k( 46) = ( 0.3515625 0.3515625 0.0000000), wk = 0.0018904 k( 47) = ( 0.3593750 0.3593750 0.0000000), wk = 0.0018904 k( 48) = ( 0.3671875 0.3671875 0.0000000), wk = 0.0018904 k( 49) = ( 0.3750000 0.3750000 0.0000000), wk = 0.0018904 k( 50) = ( 0.3828125 0.3828125 0.0000000), wk = 0.0018904 k( 51) = ( 0.3906250 0.3906250 0.0000000), wk = 0.0018904 k( 52) = ( 0.3984375 0.3984375 0.0000000), wk = 0.0018904 k( 53) = ( 0.4062500 0.4062500 0.0000000), wk = 0.0018904 k( 54) = ( 0.4140625 0.4140625 0.0000000), wk = 0.0018904 k( 55) = ( 0.4218750 0.4218750 0.0000000), wk = 0.0018904 k( 56) = ( 0.4296875 0.4296875 0.0000000), wk = 0.0018904 k( 57) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0018904 k( 58) = ( 0.4453125 0.4453125 0.0000000), wk = 0.0018904 k( 59) = ( 0.4531250 0.4531250 0.0000000), wk = 0.0018904 k( 60) = ( 0.4609375 0.4609375 0.0000000), wk = 0.0018904 k( 61) = ( 0.4687500 0.4687500 0.0000000), wk = 0.0018904 k( 62) = ( 0.4765625 0.4765625 0.0000000), wk = 0.0018904 k( 63) = ( 0.4843750 0.4843750 0.0000000), wk = 0.0018904 k( 64) = ( 0.4921875 0.4921875 0.0000000), wk = 0.0018904 k( 65) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0018904 k( 66) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0018904 k( 67) = ( 0.5001277 0.5001277 0.0004913), wk = 0.0018904 k( 68) = ( 0.5001277 0.5001277 0.0004913), wk = 0.0018904 k( 69) = ( 0.5001238 0.5001238 0.0156279), wk = 0.0018904 k( 70) = ( 0.5001200 0.5001200 0.0307645), wk = 0.0018904 k( 71) = ( 0.5001161 0.5001161 0.0459011), wk = 0.0018904 k( 72) = ( 0.5001122 0.5001122 0.0610378), wk = 0.0018904 k( 73) = ( 0.5001084 0.5001084 0.0761744), wk = 0.0018904 k( 74) = ( 0.5001045 0.5001045 0.0913110), wk = 0.0018904 k( 75) = ( 0.5001006 0.5001006 0.1064477), wk = 0.0018904 k( 76) = ( 0.5000967 0.5000968 0.1215843), wk = 0.0018904 k( 77) = ( 0.5000929 0.5000929 0.1367209), wk = 0.0018904 k( 78) = ( 0.5000890 0.5000890 0.1518575), wk = 0.0018904 k( 79) = ( 0.5000851 0.5000851 0.1669942), wk = 0.0018904 k( 80) = ( 0.5000813 0.5000813 0.1821308), wk = 0.0018904 k( 81) = ( 0.5000774 0.5000774 0.1972674), wk = 0.0018904 k( 82) = ( 0.5000735 0.5000735 0.2124041), wk = 0.0018904 k( 83) = ( 0.5000697 0.5000697 0.2275407), wk = 0.0018904 k( 84) = ( 0.5000658 0.5000658 0.2426773), wk = 0.0018904 k( 85) = ( 0.5000619 0.5000619 0.2578139), wk = 0.0018904 k( 86) = ( 0.5000581 0.5000581 0.2729506), wk = 0.0018904 k( 87) = ( 0.5000542 0.5000542 0.2880872), wk = 0.0018904 k( 88) = ( 0.5000503 0.5000503 0.3032238), wk = 0.0018904 k( 89) = ( 0.5000464 0.5000464 0.3183605), wk = 0.0018904 k( 90) = ( 0.5000426 0.5000426 0.3334971), wk = 0.0018904 k( 91) = ( 0.5000387 0.5000387 0.3486337), wk = 0.0018904 k( 92) = ( 0.5000348 0.5000348 0.3637703), wk = 0.0018904 k( 93) = ( 0.5000310 0.5000310 0.3789070), wk = 0.0018904 k( 94) = ( 0.5000271 0.5000271 0.3940436), wk = 0.0018904 k( 95) = ( 0.5000232 0.5000232 0.4091802), wk = 0.0018904 k( 96) = ( 0.5000193 0.5000193 0.4243169), wk = 0.0018904 k( 97) = ( 0.5000155 0.5000155 0.4394535), wk = 0.0018904 k( 98) = ( 0.5000116 0.5000116 0.4545901), wk = 0.0018904 k( 99) = ( 0.5000077 0.5000077 0.4697267), wk = 0.0018904 k( 100) = ( 0.5000039 0.5000039 0.4848634), wk = 0.0018904 k( 101) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0018904 k( 102) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0018904 k( 103) = ( 0.5042714 0.4957286 0.5000000), wk = 0.0018904 k( 104) = ( 0.5085428 0.4914573 0.5000000), wk = 0.0018904 k( 105) = ( 0.5128141 0.4871859 0.5000000), wk = 0.0018904 k( 106) = ( 0.5170855 0.4829145 0.5000000), wk = 0.0018904 k( 107) = ( 0.5213569 0.4786431 0.5000000), wk = 0.0018904 k( 108) = ( 0.5256283 0.4743717 0.5000000), wk = 0.0018904 k( 109) = ( 0.5298996 0.4701004 0.5000000), wk = 0.0018904 k( 110) = ( 0.5341710 0.4658290 0.5000000), wk = 0.0018904 k( 111) = ( 0.5384424 0.4615576 0.5000000), wk = 0.0018904 k( 112) = ( 0.5427137 0.4572863 0.5000000), wk = 0.0018904 k( 113) = ( 0.5469851 0.4530149 0.5000000), wk = 0.0018904 k( 114) = ( 0.5512565 0.4487435 0.5000000), wk = 0.0018904 k( 115) = ( 0.5555279 0.4444721 0.5000000), wk = 0.0018904 k( 116) = ( 0.5597992 0.4402008 0.5000000), wk = 0.0018904 k( 117) = ( 0.5640706 0.4359294 0.5000000), wk = 0.0018904 k( 118) = ( 0.5683420 0.4316580 0.5000000), wk = 0.0018904 k( 119) = ( 0.5726134 0.4273866 0.5000000), wk = 0.0018904 k( 120) = ( 0.5768847 0.4231152 0.5000000), wk = 0.0018904 k( 121) = ( 0.5811561 0.4188439 0.5000000), wk = 0.0018904 k( 122) = ( 0.5854275 0.4145725 0.5000000), wk = 0.0018904 k( 123) = ( 0.5896989 0.4103011 0.5000000), wk = 0.0018904 k( 124) = ( 0.5939703 0.4060298 0.5000000), wk = 0.0018904 k( 125) = ( 0.5982416 0.4017584 0.5000000), wk = 0.0018904 k( 126) = ( 0.6025130 0.3974870 0.5000000), wk = 0.0018904 k( 127) = ( 0.6067844 0.3932156 0.5000000), wk = 0.0018904 k( 128) = ( 0.6110558 0.3889442 0.5000000), wk = 0.0018904 k( 129) = ( 0.6153271 0.3846729 0.5000000), wk = 0.0018904 k( 130) = ( 0.6195985 0.3804015 0.5000000), wk = 0.0018904 k( 131) = ( 0.6238699 0.3761301 0.5000000), wk = 0.0018904 k( 132) = ( 0.6281413 0.3718587 0.5000000), wk = 0.0018904 k( 133) = ( 0.6324126 0.3675874 0.5000000), wk = 0.0018904 k( 134) = ( 0.6366840 0.3633160 0.5000000), wk = 0.0018904 k( 135) = ( 0.6409554 0.3590446 0.5000000), wk = 0.0018904 k( 136) = ( 0.6452268 0.3547732 0.5000000), wk = 0.0018904 k( 137) = ( 0.6494981 0.3505019 0.5000000), wk = 0.0018904 k( 138) = ( 0.6537695 0.3462305 0.5000000), wk = 0.0018904 k( 139) = ( 0.6580409 0.3419591 0.5000000), wk = 0.0018904 k( 140) = ( 0.6623123 0.3376877 0.5000000), wk = 0.0018904 k( 141) = ( 0.6665836 0.3334164 0.5000000), wk = 0.0018904 k( 142) = ( 0.6708550 0.3291450 0.5000000), wk = 0.0018904 k( 143) = ( 0.6751264 0.3248736 0.5000000), wk = 0.0018904 k( 144) = ( 0.6793978 0.3206022 0.5000000), wk = 0.0018904 k( 145) = ( 0.6836691 0.3163309 0.5000000), wk = 0.0018904 k( 146) = ( 0.6879405 0.3120595 0.5000000), wk = 0.0018904 k( 147) = ( 0.6922119 0.3077881 0.5000000), wk = 0.0018904 k( 148) = ( 0.6964833 0.3035167 0.5000000), wk = 0.0018904 k( 149) = ( 0.7007546 0.2992454 0.5000000), wk = 0.0018904 k( 150) = ( 0.7050260 0.2949740 0.5000000), wk = 0.0018904 k( 151) = ( 0.7092974 0.2907026 0.5000000), wk = 0.0018904 k( 152) = ( 0.7135688 0.2864312 0.5000000), wk = 0.0018904 k( 153) = ( 0.2864312 -0.2864312 0.5000000), wk = 0.0018904 k( 154) = ( 0.2821561 -0.2821561 0.5000000), wk = 0.0018904 k( 155) = ( 0.2778811 -0.2778811 0.5000000), wk = 0.0018904 k( 156) = ( 0.2736060 -0.2736060 0.5000000), wk = 0.0018904 k( 157) = ( 0.2693309 -0.2693309 0.5000000), wk = 0.0018904 k( 158) = ( 0.2650558 -0.2650558 0.5000000), wk = 0.0018904 k( 159) = ( 0.2607807 -0.2607807 0.5000000), wk = 0.0018904 k( 160) = ( 0.2565056 -0.2565056 0.5000000), wk = 0.0018904 k( 161) = ( 0.2522305 -0.2522305 0.5000000), wk = 0.0018904 k( 162) = ( 0.2479554 -0.2479554 0.5000000), wk = 0.0018904 k( 163) = ( 0.2436803 -0.2436803 0.5000000), wk = 0.0018904 k( 164) = ( 0.2394052 -0.2394052 0.5000000), wk = 0.0018904 k( 165) = ( 0.2351301 -0.2351301 0.5000000), wk = 0.0018904 k( 166) = ( 0.2308550 -0.2308550 0.5000000), wk = 0.0018904 k( 167) = ( 0.2265799 -0.2265799 0.5000000), wk = 0.0018904 k( 168) = ( 0.2223048 -0.2223048 0.5000000), wk = 0.0018904 k( 169) = ( 0.2180297 -0.2180297 0.5000000), wk = 0.0018904 k( 170) = ( 0.2137547 -0.2137547 0.5000000), wk = 0.0018904 k( 171) = ( 0.2094796 -0.2094796 0.5000000), wk = 0.0018904 k( 172) = ( 0.2052045 -0.2052045 0.5000000), wk = 0.0018904 k( 173) = ( 0.2009294 -0.2009294 0.5000000), wk = 0.0018904 k( 174) = ( 0.1966543 -0.1966543 0.5000000), wk = 0.0018904 k( 175) = ( 0.1923792 -0.1923792 0.5000000), wk = 0.0018904 k( 176) = ( 0.1881041 -0.1881041 0.5000000), wk = 0.0018904 k( 177) = ( 0.1838290 -0.1838290 0.5000000), wk = 0.0018904 k( 178) = ( 0.1795539 -0.1795539 0.5000000), wk = 0.0018904 k( 179) = ( 0.1752788 -0.1752788 0.5000000), wk = 0.0018904 k( 180) = ( 0.1710037 -0.1710037 0.5000000), wk = 0.0018904 k( 181) = ( 0.1667286 -0.1667286 0.5000000), wk = 0.0018904 k( 182) = ( 0.1624535 -0.1624535 0.5000000), wk = 0.0018904 k( 183) = ( 0.1581784 -0.1581784 0.5000000), wk = 0.0018904 k( 184) = ( 0.1539033 -0.1539034 0.5000000), wk = 0.0018904 k( 185) = ( 0.1496283 -0.1496283 0.5000000), wk = 0.0018904 k( 186) = ( 0.1453532 -0.1453532 0.5000000), wk = 0.0018904 k( 187) = ( 0.1410781 -0.1410781 0.5000000), wk = 0.0018904 k( 188) = ( 0.1368030 -0.1368030 0.5000000), wk = 0.0018904 k( 189) = ( 0.1325279 -0.1325279 0.5000000), wk = 0.0018904 k( 190) = ( 0.1282528 -0.1282528 0.5000000), wk = 0.0018904 k( 191) = ( 0.1239777 -0.1239777 0.5000000), wk = 0.0018904 k( 192) = ( 0.1197026 -0.1197026 0.5000000), wk = 0.0018904 k( 193) = ( 0.1154275 -0.1154275 0.5000000), wk = 0.0018904 k( 194) = ( 0.1111524 -0.1111524 0.5000000), wk = 0.0018904 k( 195) = ( 0.1068773 -0.1068773 0.5000000), wk = 0.0018904 k( 196) = ( 0.1026022 -0.1026022 0.5000000), wk = 0.0018904 k( 197) = ( 0.0983271 -0.0983271 0.5000000), wk = 0.0018904 k( 198) = ( 0.0940520 -0.0940520 0.5000000), wk = 0.0018904 k( 199) = ( 0.0897770 -0.0897770 0.5000000), wk = 0.0018904 k( 200) = ( 0.0855019 -0.0855019 0.5000000), wk = 0.0018904 k( 201) = ( 0.0812268 -0.0812268 0.5000000), wk = 0.0018904 k( 202) = ( 0.0769517 -0.0769517 0.5000000), wk = 0.0018904 k( 203) = ( 0.0726766 -0.0726766 0.5000000), wk = 0.0018904 k( 204) = ( 0.0684015 -0.0684015 0.5000000), wk = 0.0018904 k( 205) = ( 0.0641264 -0.0641264 0.5000000), wk = 0.0018904 k( 206) = ( 0.0598513 -0.0598513 0.5000000), wk = 0.0018904 k( 207) = ( 0.0555762 -0.0555762 0.5000000), wk = 0.0018904 k( 208) = ( 0.0513011 -0.0513011 0.5000000), wk = 0.0018904 k( 209) = ( 0.0470260 -0.0470260 0.5000000), wk = 0.0018904 k( 210) = ( 0.0427509 -0.0427509 0.5000000), wk = 0.0018904 k( 211) = ( 0.0384758 -0.0384758 0.5000000), wk = 0.0018904 k( 212) = ( 0.0342008 -0.0342007 0.5000000), wk = 0.0018904 k( 213) = ( 0.0299257 -0.0299256 0.5000000), wk = 0.0018904 k( 214) = ( 0.0256506 -0.0256506 0.5000000), wk = 0.0018904 k( 215) = ( 0.0213755 -0.0213755 0.5000000), wk = 0.0018904 k( 216) = ( 0.0171004 -0.0171004 0.5000000), wk = 0.0018904 k( 217) = ( 0.0128253 -0.0128253 0.5000000), wk = 0.0018904 k( 218) = ( 0.0085502 -0.0085502 0.5000000), wk = 0.0018904 k( 219) = ( 0.0042751 -0.0042751 0.5000000), wk = 0.0018904 k( 220) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0018904 k( 221) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0018904 k( 222) = ( 0.0090886 0.0090886 0.5090820), wk = 0.0018904 k( 223) = ( 0.0181772 0.0181772 0.5181640), wk = 0.0018904 k( 224) = ( 0.0272658 0.0272658 0.5272459), wk = 0.0018904 k( 225) = ( 0.0363544 0.0363544 0.5363279), wk = 0.0018904 k( 226) = ( 0.0454429 0.0454429 0.5454099), wk = 0.0018904 k( 227) = ( 0.0545315 0.0545315 0.5544919), wk = 0.0018904 k( 228) = ( 0.0636201 0.0636201 0.5635738), wk = 0.0018904 k( 229) = ( 0.0727087 0.0727087 0.5726558), wk = 0.0018904 k( 230) = ( 0.0817973 0.0817973 0.5817378), wk = 0.0018904 k( 231) = ( 0.0908859 0.0908859 0.5908198), wk = 0.0018904 k( 232) = ( 0.0999745 0.0999745 0.5999018), wk = 0.0018904 k( 233) = ( 0.1090630 0.1090630 0.6089837), wk = 0.0018904 k( 234) = ( 0.1181516 0.1181516 0.6180657), wk = 0.0018904 k( 235) = ( 0.1272402 0.1272402 0.6271477), wk = 0.0018904 k( 236) = ( 0.1363288 0.1363288 0.6362297), wk = 0.0018904 k( 237) = ( 0.1454174 0.1454174 0.6453116), wk = 0.0018904 k( 238) = ( 0.1545060 0.1545060 0.6543936), wk = 0.0018904 k( 239) = ( 0.1635946 0.1635946 0.6634756), wk = 0.0018904 k( 240) = ( 0.1726832 0.1726832 0.6725576), wk = 0.0018904 k( 241) = ( 0.1817717 0.1817717 0.6816395), wk = 0.0018904 k( 242) = ( 0.1908603 0.1908603 0.6907215), wk = 0.0018904 k( 243) = ( 0.1999489 0.1999489 0.6998035), wk = 0.0018904 k( 244) = ( 0.2090375 0.2090375 0.7088855), wk = 0.0018904 k( 245) = ( 0.2181261 0.2181261 0.7179675), wk = 0.0018904 k( 246) = ( 0.2272147 0.2272147 0.7270494), wk = 0.0018904 k( 247) = ( 0.2363033 0.2363033 0.7361314), wk = 0.0018904 k( 248) = ( 0.2453918 0.2453918 0.7452134), wk = 0.0018904 k( 249) = ( 0.2544804 0.2544804 0.7542954), wk = 0.0018904 k( 250) = ( 0.2635690 0.2635690 0.7633773), wk = 0.0018904 k( 251) = ( 0.2726576 0.2726576 0.7724593), wk = 0.0018904 k( 252) = ( 0.2817462 0.2817462 0.7815413), wk = 0.0018904 k( 253) = ( 0.2908348 0.2908348 0.7906233), wk = 0.0018904 k( 254) = ( 0.2999234 0.2999234 0.7997053), wk = 0.0018904 k( 255) = ( 0.3090120 0.3090120 0.8087872), wk = 0.0018904 k( 256) = ( 0.3181005 0.3181005 0.8178692), wk = 0.0018904 k( 257) = ( 0.3271891 0.3271891 0.8269512), wk = 0.0018904 k( 258) = ( 0.3362777 0.3362777 0.8360332), wk = 0.0018904 k( 259) = ( 0.3453663 0.3453663 0.8451151), wk = 0.0018904 k( 260) = ( 0.3544549 0.3544549 0.8541971), wk = 0.0018904 k( 261) = ( 0.3635435 0.3635435 0.8632791), wk = 0.0018904 k( 262) = ( 0.3726321 0.3726321 0.8723611), wk = 0.0018904 k( 263) = ( 0.3817206 0.3817206 0.8814430), wk = 0.0018904 k( 264) = ( 0.3908092 0.3908092 0.8905250), wk = 0.0018904 k( 265) = ( 0.3998978 0.3998978 0.8996070), wk = 0.0018904 k( 266) = ( 0.4089864 0.4089864 0.9086890), wk = 0.0018904 k( 267) = ( 0.4180750 0.4180750 0.9177710), wk = 0.0018904 k( 268) = ( 0.4271636 0.4271636 0.9268529), wk = 0.0018904 k( 269) = ( 0.4362522 0.4362522 0.9359349), wk = 0.0018904 k( 270) = ( 0.4453408 0.4453408 0.9450169), wk = 0.0018904 k( 271) = ( 0.4544294 0.4544294 0.9540989), wk = 0.0018904 k( 272) = ( 0.4635179 0.4635179 0.9631808), wk = 0.0018904 k( 273) = ( 0.4726065 0.4726065 0.9722628), wk = 0.0018904 k( 274) = ( 0.4816951 0.4816951 0.9813448), wk = 0.0018904 k( 275) = ( 0.4907837 0.4907837 0.9904268), wk = 0.0018904 k( 276) = ( 0.4998723 0.4998723 0.9995088), wk = 0.0018904 k( 277) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0018904 k( 278) = ( 0.5042466 0.4957534 0.0000000), wk = 0.0018904 k( 279) = ( 0.5084931 0.4915069 0.0000000), wk = 0.0018904 k( 280) = ( 0.5127397 0.4872603 0.0000000), wk = 0.0018904 k( 281) = ( 0.5169862 0.4830138 0.0000000), wk = 0.0018904 k( 282) = ( 0.5212328 0.4787672 0.0000000), wk = 0.0018904 k( 283) = ( 0.5254794 0.4745207 0.0000000), wk = 0.0018904 k( 284) = ( 0.5297259 0.4702741 0.0000000), wk = 0.0018904 k( 285) = ( 0.5339725 0.4660275 0.0000000), wk = 0.0018904 k( 286) = ( 0.5382190 0.4617810 0.0000000), wk = 0.0018904 k( 287) = ( 0.5424656 0.4575344 0.0000000), wk = 0.0018904 k( 288) = ( 0.5467121 0.4532879 0.0000000), wk = 0.0018904 k( 289) = ( 0.5509587 0.4490413 0.0000000), wk = 0.0018904 k( 290) = ( 0.5552052 0.4447948 0.0000000), wk = 0.0018904 k( 291) = ( 0.5594518 0.4405482 0.0000000), wk = 0.0018904 k( 292) = ( 0.5636984 0.4363016 0.0000000), wk = 0.0018904 k( 293) = ( 0.5679449 0.4320551 0.0000000), wk = 0.0018904 k( 294) = ( 0.5721915 0.4278085 0.0000000), wk = 0.0018904 k( 295) = ( 0.5764380 0.4235620 0.0000000), wk = 0.0018904 k( 296) = ( 0.5806846 0.4193154 0.0000000), wk = 0.0018904 k( 297) = ( 0.5849312 0.4150688 0.0000000), wk = 0.0018904 k( 298) = ( 0.5891777 0.4108223 0.0000000), wk = 0.0018904 k( 299) = ( 0.5934243 0.4065757 0.0000000), wk = 0.0018904 k( 300) = ( 0.5976708 0.4023292 0.0000000), wk = 0.0018904 k( 301) = ( 0.6019174 0.3980826 0.0000000), wk = 0.0018904 k( 302) = ( 0.6061640 0.3938360 0.0000000), wk = 0.0018904 k( 303) = ( 0.6104105 0.3895895 0.0000000), wk = 0.0018904 k( 304) = ( 0.6146571 0.3853429 0.0000000), wk = 0.0018904 k( 305) = ( 0.6189036 0.3810964 0.0000000), wk = 0.0018904 k( 306) = ( 0.6231502 0.3768498 0.0000000), wk = 0.0018904 k( 307) = ( 0.6273967 0.3726033 0.0000000), wk = 0.0018904 k( 308) = ( 0.6316433 0.3683567 0.0000000), wk = 0.0018904 k( 309) = ( 0.6358898 0.3641102 0.0000000), wk = 0.0018904 k( 310) = ( 0.6401364 0.3598636 0.0000000), wk = 0.0018904 k( 311) = ( 0.6443830 0.3556170 0.0000000), wk = 0.0018904 k( 312) = ( 0.6486295 0.3513705 0.0000000), wk = 0.0018904 k( 313) = ( 0.6528761 0.3471239 0.0000000), wk = 0.0018904 k( 314) = ( 0.6571226 0.3428774 0.0000000), wk = 0.0018904 k( 315) = ( 0.6613692 0.3386308 0.0000000), wk = 0.0018904 k( 316) = ( 0.6656158 0.3343842 0.0000000), wk = 0.0018904 k( 317) = ( 0.6698623 0.3301377 0.0000000), wk = 0.0018904 k( 318) = ( 0.6741089 0.3258911 0.0000000), wk = 0.0018904 k( 319) = ( 0.3258911 -0.3258911 -0.0000000), wk = 0.0018904 k( 320) = ( 0.3216031 -0.3216031 0.0000000), wk = 0.0018904 k( 321) = ( 0.3173150 -0.3173150 0.0000000), wk = 0.0018904 k( 322) = ( 0.3130270 -0.3130270 0.0000000), wk = 0.0018904 k( 323) = ( 0.3087390 -0.3087390 0.0000000), wk = 0.0018904 k( 324) = ( 0.3044509 -0.3044509 0.0000000), wk = 0.0018904 k( 325) = ( 0.3001629 -0.3001629 0.0000000), wk = 0.0018904 k( 326) = ( 0.2958748 -0.2958748 0.0000000), wk = 0.0018904 k( 327) = ( 0.2915868 -0.2915868 0.0000000), wk = 0.0018904 k( 328) = ( 0.2872987 -0.2872988 -0.0000000), wk = 0.0018904 k( 329) = ( 0.2830107 -0.2830107 -0.0000000), wk = 0.0018904 k( 330) = ( 0.2787227 -0.2787227 0.0000000), wk = 0.0018904 k( 331) = ( 0.2744346 -0.2744346 0.0000000), wk = 0.0018904 k( 332) = ( 0.2701466 -0.2701466 0.0000000), wk = 0.0018904 k( 333) = ( 0.2658586 -0.2658586 0.0000000), wk = 0.0018904 k( 334) = ( 0.2615705 -0.2615705 0.0000000), wk = 0.0018904 k( 335) = ( 0.2572825 -0.2572825 0.0000000), wk = 0.0018904 k( 336) = ( 0.2529944 -0.2529944 0.0000000), wk = 0.0018904 k( 337) = ( 0.2487064 -0.2487064 0.0000000), wk = 0.0018904 k( 338) = ( 0.2444183 -0.2444183 0.0000000), wk = 0.0018904 k( 339) = ( 0.2401303 -0.2401303 0.0000000), wk = 0.0018904 k( 340) = ( 0.2358423 -0.2358423 0.0000000), wk = 0.0018904 k( 341) = ( 0.2315542 -0.2315542 0.0000000), wk = 0.0018904 k( 342) = ( 0.2272662 -0.2272662 0.0000000), wk = 0.0018904 k( 343) = ( 0.2229781 -0.2229781 -0.0000000), wk = 0.0018904 k( 344) = ( 0.2186901 -0.2186901 0.0000000), wk = 0.0018904 k( 345) = ( 0.2144021 -0.2144021 0.0000000), wk = 0.0018904 k( 346) = ( 0.2101140 -0.2101140 -0.0000000), wk = 0.0018904 k( 347) = ( 0.2058260 -0.2058260 0.0000000), wk = 0.0018904 k( 348) = ( 0.2015379 -0.2015379 0.0000000), wk = 0.0018904 k( 349) = ( 0.1972499 -0.1972499 -0.0000000), wk = 0.0018904 k( 350) = ( 0.1929618 -0.1929619 0.0000000), wk = 0.0018904 k( 351) = ( 0.1886738 -0.1886738 0.0000000), wk = 0.0018904 k( 352) = ( 0.1843858 -0.1843858 0.0000000), wk = 0.0018904 k( 353) = ( 0.1800977 -0.1800977 0.0000000), wk = 0.0018904 k( 354) = ( 0.1758097 -0.1758097 0.0000000), wk = 0.0018904 k( 355) = ( 0.1715216 -0.1715216 0.0000000), wk = 0.0018904 k( 356) = ( 0.1672336 -0.1672336 -0.0000000), wk = 0.0018904 k( 357) = ( 0.1629456 -0.1629456 -0.0000000), wk = 0.0018904 k( 358) = ( 0.1586575 -0.1586575 0.0000000), wk = 0.0018904 k( 359) = ( 0.1543695 -0.1543695 0.0000000), wk = 0.0018904 k( 360) = ( 0.1500814 -0.1500814 0.0000000), wk = 0.0018904 k( 361) = ( 0.1457934 -0.1457934 0.0000000), wk = 0.0018904 k( 362) = ( 0.1415054 -0.1415054 0.0000000), wk = 0.0018904 k( 363) = ( 0.1372173 -0.1372173 0.0000000), wk = 0.0018904 k( 364) = ( 0.1329293 -0.1329293 0.0000000), wk = 0.0018904 k( 365) = ( 0.1286412 -0.1286412 0.0000000), wk = 0.0018904 k( 366) = ( 0.1243532 -0.1243532 0.0000000), wk = 0.0018904 k( 367) = ( 0.1200651 -0.1200652 0.0000000), wk = 0.0018904 k( 368) = ( 0.1157771 -0.1157771 0.0000000), wk = 0.0018904 k( 369) = ( 0.1114891 -0.1114891 -0.0000000), wk = 0.0018904 k( 370) = ( 0.1072010 -0.1072010 0.0000000), wk = 0.0018904 k( 371) = ( 0.1029130 -0.1029130 0.0000000), wk = 0.0018904 k( 372) = ( 0.0986250 -0.0986250 0.0000000), wk = 0.0018904 k( 373) = ( 0.0943369 -0.0943369 0.0000000), wk = 0.0018904 k( 374) = ( 0.0900489 -0.0900489 -0.0000000), wk = 0.0018904 k( 375) = ( 0.0857608 -0.0857608 0.0000000), wk = 0.0018904 k( 376) = ( 0.0814728 -0.0814728 -0.0000000), wk = 0.0018904 k( 377) = ( 0.0771847 -0.0771847 0.0000000), wk = 0.0018904 k( 378) = ( 0.0728967 -0.0728967 0.0000000), wk = 0.0018904 k( 379) = ( 0.0686087 -0.0686087 0.0000000), wk = 0.0018904 k( 380) = ( 0.0643206 -0.0643206 -0.0000000), wk = 0.0018904 k( 381) = ( 0.0600326 -0.0600326 0.0000000), wk = 0.0018904 k( 382) = ( 0.0557445 -0.0557445 0.0000000), wk = 0.0018904 k( 383) = ( 0.0514565 -0.0514565 0.0000000), wk = 0.0018904 k( 384) = ( 0.0471685 -0.0471685 0.0000000), wk = 0.0018904 k( 385) = ( 0.0428804 -0.0428804 0.0000000), wk = 0.0018904 k( 386) = ( 0.0385924 -0.0385924 0.0000000), wk = 0.0018904 k( 387) = ( 0.0343043 -0.0343043 0.0000000), wk = 0.0018904 k( 388) = ( 0.0300163 -0.0300163 0.0000000), wk = 0.0018904 k( 389) = ( 0.0257283 -0.0257282 0.0000000), wk = 0.0018904 k( 390) = ( 0.0214402 -0.0214402 0.0000000), wk = 0.0018904 k( 391) = ( 0.0171522 -0.0171522 0.0000000), wk = 0.0018904 k( 392) = ( 0.0128641 -0.0128641 0.0000000), wk = 0.0018904 k( 393) = ( 0.0085761 -0.0085761 0.0000000), wk = 0.0018904 k( 394) = ( 0.0042880 -0.0042880 0.0000000), wk = 0.0018904 k( 395) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018904 k( 396) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018904 k( 397) = ( 0.0075758 -0.0000000 0.0000000), wk = 0.0018904 k( 398) = ( 0.0151515 -0.0000000 0.0000000), wk = 0.0018904 k( 399) = ( 0.0227273 -0.0000000 0.0000000), wk = 0.0018904 k( 400) = ( 0.0303030 -0.0000000 0.0000000), wk = 0.0018904 k( 401) = ( 0.0378788 -0.0000000 0.0000000), wk = 0.0018904 k( 402) = ( 0.0454546 0.0000000 0.0000000), wk = 0.0018904 k( 403) = ( 0.0530303 -0.0000000 0.0000000), wk = 0.0018904 k( 404) = ( 0.0606061 -0.0000000 0.0000000), wk = 0.0018904 k( 405) = ( 0.0681818 0.0000000 0.0000000), wk = 0.0018904 k( 406) = ( 0.0757576 -0.0000000 0.0000000), wk = 0.0018904 k( 407) = ( 0.0833333 0.0000000 0.0000000), wk = 0.0018904 k( 408) = ( 0.0909091 -0.0000000 0.0000000), wk = 0.0018904 k( 409) = ( 0.0984848 -0.0000000 0.0000000), wk = 0.0018904 k( 410) = ( 0.1060606 0.0000000 0.0000000), wk = 0.0018904 k( 411) = ( 0.1136364 0.0000000 0.0000000), wk = 0.0018904 k( 412) = ( 0.1212121 -0.0000000 0.0000000), wk = 0.0018904 k( 413) = ( 0.1287879 0.0000000 0.0000000), wk = 0.0018904 k( 414) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0018904 k( 415) = ( 0.1439394 -0.0000000 0.0000000), wk = 0.0018904 k( 416) = ( 0.1515151 0.0000000 0.0000000), wk = 0.0018904 k( 417) = ( 0.1590909 -0.0000000 0.0000000), wk = 0.0018904 k( 418) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0018904 k( 419) = ( 0.1742424 -0.0000000 0.0000000), wk = 0.0018904 k( 420) = ( 0.1818182 -0.0000000 0.0000000), wk = 0.0018904 k( 421) = ( 0.1893939 0.0000000 0.0000000), wk = 0.0018904 k( 422) = ( 0.1969697 -0.0000000 0.0000000), wk = 0.0018904 k( 423) = ( 0.2045454 0.0000000 0.0000000), wk = 0.0018904 k( 424) = ( 0.2121212 -0.0000000 0.0000000), wk = 0.0018904 k( 425) = ( 0.2196970 -0.0000000 0.0000000), wk = 0.0018904 k( 426) = ( 0.2272727 -0.0000000 0.0000000), wk = 0.0018904 k( 427) = ( 0.2348485 0.0000000 0.0000000), wk = 0.0018904 k( 428) = ( 0.2424242 -0.0000000 0.0000000), wk = 0.0018904 k( 429) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0018904 k( 430) = ( 0.2575758 0.0000000 0.0000000), wk = 0.0018904 k( 431) = ( 0.2651515 -0.0000000 0.0000000), wk = 0.0018904 k( 432) = ( 0.2727273 -0.0000000 0.0000000), wk = 0.0018904 k( 433) = ( 0.2803030 0.0000000 0.0000000), wk = 0.0018904 k( 434) = ( 0.2878788 0.0000000 0.0000000), wk = 0.0018904 k( 435) = ( 0.2954545 -0.0000000 0.0000000), wk = 0.0018904 k( 436) = ( 0.3030303 0.0000000 0.0000000), wk = 0.0018904 k( 437) = ( 0.3106061 -0.0000000 0.0000000), wk = 0.0018904 k( 438) = ( 0.3181818 -0.0000000 0.0000000), wk = 0.0018904 k( 439) = ( 0.3257576 -0.0000000 0.0000000), wk = 0.0018904 k( 440) = ( 0.3333333 -0.0000000 0.0000000), wk = 0.0018904 k( 441) = ( 0.3409091 -0.0000000 0.0000000), wk = 0.0018904 k( 442) = ( 0.3484849 0.0000000 0.0000000), wk = 0.0018904 k( 443) = ( 0.3560606 0.0000000 0.0000000), wk = 0.0018904 k( 444) = ( 0.3636364 -0.0000000 0.0000000), wk = 0.0018904 k( 445) = ( 0.3712121 -0.0000000 0.0000000), wk = 0.0018904 k( 446) = ( 0.3787879 0.0000000 0.0000000), wk = 0.0018904 k( 447) = ( 0.3863636 0.0000000 0.0000000), wk = 0.0018904 k( 448) = ( 0.3939394 -0.0000000 0.0000000), wk = 0.0018904 k( 449) = ( 0.4015151 0.0000000 0.0000000), wk = 0.0018904 k( 450) = ( 0.4090909 0.0000000 0.0000000), wk = 0.0018904 k( 451) = ( 0.4166667 0.0000000 0.0000000), wk = 0.0018904 k( 452) = ( 0.4242424 -0.0000000 0.0000000), wk = 0.0018904 k( 453) = ( 0.4318182 0.0000000 0.0000000), wk = 0.0018904 k( 454) = ( 0.4393939 -0.0000000 0.0000000), wk = 0.0018904 k( 455) = ( 0.4469697 -0.0000000 0.0000000), wk = 0.0018904 k( 456) = ( 0.4545455 0.0000000 0.0000000), wk = 0.0018904 k( 457) = ( 0.4621212 0.0000000 0.0000000), wk = 0.0018904 k( 458) = ( 0.4696970 0.0000000 0.0000000), wk = 0.0018904 k( 459) = ( 0.4772727 -0.0000000 0.0000000), wk = 0.0018904 k( 460) = ( 0.4848485 -0.0000000 0.0000000), wk = 0.0018904 k( 461) = ( 0.4924242 -0.0000000 0.0000000), wk = 0.0018904 k( 462) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0018904 k( 463) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0018904 k( 464) = ( 0.4924242 -0.0000000 0.4924242), wk = 0.0018904 k( 465) = ( 0.4848485 -0.0000000 0.4848485), wk = 0.0018904 k( 466) = ( 0.4772727 -0.0000000 0.4772727), wk = 0.0018904 k( 467) = ( 0.4696970 0.0000000 0.4696970), wk = 0.0018904 k( 468) = ( 0.4621212 0.0000000 0.4621212), wk = 0.0018904 k( 469) = ( 0.4545455 0.0000000 0.4545455), wk = 0.0018904 k( 470) = ( 0.4469697 -0.0000000 0.4469697), wk = 0.0018904 k( 471) = ( 0.4393939 -0.0000000 0.4393939), wk = 0.0018904 k( 472) = ( 0.4318182 0.0000000 0.4318182), wk = 0.0018904 k( 473) = ( 0.4242424 -0.0000000 0.4242424), wk = 0.0018904 k( 474) = ( 0.4166667 0.0000000 0.4166667), wk = 0.0018904 k( 475) = ( 0.4090909 0.0000000 0.4090909), wk = 0.0018904 k( 476) = ( 0.4015151 0.0000000 0.4015152), wk = 0.0018904 k( 477) = ( 0.3939394 -0.0000000 0.3939394), wk = 0.0018904 k( 478) = ( 0.3863636 0.0000000 0.3863636), wk = 0.0018904 k( 479) = ( 0.3787879 0.0000000 0.3787879), wk = 0.0018904 k( 480) = ( 0.3712121 -0.0000000 0.3712121), wk = 0.0018904 k( 481) = ( 0.3636364 -0.0000000 0.3636364), wk = 0.0018904 k( 482) = ( 0.3560606 0.0000000 0.3560606), wk = 0.0018904 k( 483) = ( 0.3484849 0.0000000 0.3484849), wk = 0.0018904 k( 484) = ( 0.3409091 -0.0000000 0.3409091), wk = 0.0018904 k( 485) = ( 0.3333333 -0.0000000 0.3333333), wk = 0.0018904 k( 486) = ( 0.3257576 -0.0000000 0.3257576), wk = 0.0018904 k( 487) = ( 0.3181818 -0.0000000 0.3181818), wk = 0.0018904 k( 488) = ( 0.3106061 -0.0000000 0.3106061), wk = 0.0018904 k( 489) = ( 0.3030303 0.0000000 0.3030303), wk = 0.0018904 k( 490) = ( 0.2954545 -0.0000000 0.2954546), wk = 0.0018904 k( 491) = ( 0.2878788 0.0000000 0.2878788), wk = 0.0018904 k( 492) = ( 0.2803030 0.0000000 0.2803030), wk = 0.0018904 k( 493) = ( 0.2727273 -0.0000000 0.2727273), wk = 0.0018904 k( 494) = ( 0.2651515 -0.0000000 0.2651515), wk = 0.0018904 k( 495) = ( 0.2575758 0.0000000 0.2575758), wk = 0.0018904 k( 496) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0018904 k( 497) = ( 0.2424242 -0.0000000 0.2424242), wk = 0.0018904 k( 498) = ( 0.2348485 0.0000000 0.2348485), wk = 0.0018904 k( 499) = ( 0.2272727 -0.0000000 0.2272727), wk = 0.0018904 k( 500) = ( 0.2196970 -0.0000000 0.2196970), wk = 0.0018904 k( 501) = ( 0.2121212 -0.0000000 0.2121212), wk = 0.0018904 k( 502) = ( 0.2045454 0.0000000 0.2045455), wk = 0.0018904 k( 503) = ( 0.1969697 -0.0000000 0.1969697), wk = 0.0018904 k( 504) = ( 0.1893939 0.0000000 0.1893939), wk = 0.0018904 k( 505) = ( 0.1818182 -0.0000000 0.1818182), wk = 0.0018904 k( 506) = ( 0.1742424 -0.0000000 0.1742424), wk = 0.0018904 k( 507) = ( 0.1666667 0.0000000 0.1666667), wk = 0.0018904 k( 508) = ( 0.1590909 -0.0000000 0.1590909), wk = 0.0018904 k( 509) = ( 0.1515151 0.0000000 0.1515152), wk = 0.0018904 k( 510) = ( 0.1439394 -0.0000000 0.1439394), wk = 0.0018904 k( 511) = ( 0.1363636 0.0000000 0.1363636), wk = 0.0018904 k( 512) = ( 0.1287879 0.0000000 0.1287879), wk = 0.0018904 k( 513) = ( 0.1212121 -0.0000000 0.1212121), wk = 0.0018904 k( 514) = ( 0.1136364 0.0000000 0.1136364), wk = 0.0018904 k( 515) = ( 0.1060606 0.0000000 0.1060606), wk = 0.0018904 k( 516) = ( 0.0984848 -0.0000000 0.0984849), wk = 0.0018904 k( 517) = ( 0.0909091 -0.0000000 0.0909091), wk = 0.0018904 k( 518) = ( 0.0833333 0.0000000 0.0833333), wk = 0.0018904 k( 519) = ( 0.0757576 -0.0000000 0.0757576), wk = 0.0018904 k( 520) = ( 0.0681818 0.0000000 0.0681818), wk = 0.0018904 k( 521) = ( 0.0606061 -0.0000000 0.0606061), wk = 0.0018904 k( 522) = ( 0.0530303 -0.0000000 0.0530303), wk = 0.0018904 k( 523) = ( 0.0454546 0.0000000 0.0454546), wk = 0.0018904 k( 524) = ( 0.0378788 -0.0000000 0.0378788), wk = 0.0018904 k( 525) = ( 0.0303030 -0.0000000 0.0303030), wk = 0.0018904 k( 526) = ( 0.0227273 -0.0000000 0.0227273), wk = 0.0018904 k( 527) = ( 0.0151515 -0.0000000 0.0151515), wk = 0.0018904 k( 528) = ( 0.0075758 -0.0000000 0.0075758), wk = 0.0018904 k( 529) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018904 Dense grid: 35951 G-vectors FFT dimensions: ( 40, 40, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.13 Mb ( 254, 34) NL pseudopotentials 0.15 Mb ( 127, 76) Each V/rho on FFT grid 0.05 Mb ( 3200) Each G-vector array 0.01 Mb ( 997) G-vector shells 0.01 Mb ( 997) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.53 Mb ( 254, 136) Each subspace H/S matrix 0.02 Mb ( 34, 34) Each matrix 0.08 Mb ( 76, 2, 34) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./LiCuO2.save/charge-density.dat Starting wfc are 44 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.2 secs Computing kpt #: 2 total cpu time spent up to now is 3.4 secs Computing kpt #: 3 total cpu time spent up to now is 3.6 secs Computing kpt #: 4 total cpu time spent up to now is 3.7 secs Computing kpt #: 5 total cpu time spent up to now is 3.9 secs Computing kpt #: 6 total cpu time spent up to now is 4.1 secs Computing kpt #: 7 total cpu time spent up to now is 4.3 secs Computing kpt #: 8 total cpu time spent up to now is 4.5 secs Computing kpt #: 9 total cpu time spent up to now is 4.7 secs Computing kpt #: 10 total cpu time spent up to now is 4.9 secs Computing kpt #: 11 total cpu time spent up to now is 5.2 secs Computing kpt #: 12 total cpu time spent up to now is 5.4 secs Computing kpt #: 13 total cpu time spent up to now is 5.6 secs Computing kpt #: 14 total cpu time spent up to now is 5.8 secs Computing kpt #: 15 total cpu time spent up to now is 6.0 secs Computing kpt #: 16 total cpu time spent up to now is 6.2 secs Computing kpt #: 17 total cpu time spent up to now is 6.4 secs Computing kpt #: 18 total cpu time spent up to now is 6.7 secs Computing kpt #: 19 total cpu time spent up to now is 6.9 secs Computing kpt #: 20 total cpu time spent up to now is 7.1 secs Computing kpt #: 21 total cpu time spent up to now is 7.3 secs Computing kpt #: 22 total cpu time spent up to now is 7.5 secs Computing kpt #: 23 total cpu time spent up to now is 7.7 secs Computing kpt #: 24 total cpu time spent up to now is 7.9 secs Computing kpt #: 25 total cpu time spent up to now is 8.1 secs Computing kpt #: 26 total cpu time spent up to now is 8.4 secs Computing kpt #: 27 total cpu time spent up to now is 8.6 secs Computing kpt #: 28 total cpu time spent up to now is 8.8 secs Computing kpt #: 29 total cpu time spent up to now is 9.0 secs Computing kpt #: 30 total cpu time spent up to now is 9.2 secs Computing kpt #: 31 total cpu time spent up to now is 9.4 secs Computing kpt #: 32 total cpu time spent up to now is 9.7 secs Computing kpt #: 33 total cpu time spent up to now is 9.9 secs Computing kpt #: 34 total cpu time spent up to now is 10.1 secs Computing kpt #: 35 total cpu time spent up to now is 10.3 secs Computing kpt #: 36 total cpu time spent up to now is 10.5 secs Computing kpt #: 37 total cpu time spent up to now is 10.7 secs Computing kpt #: 38 total cpu time spent up to now is 10.9 secs Computing kpt #: 39 total cpu time spent up to now is 11.1 secs Computing kpt #: 40 total cpu time spent up to now is 11.4 secs Computing kpt #: 41 total cpu time spent up to now is 11.6 secs Computing kpt #: 42 total cpu time spent up to now is 11.8 secs Computing kpt #: 43 total cpu time spent up to now is 12.0 secs Computing kpt #: 44 total cpu time spent up to now is 12.2 secs Computing kpt #: 45 total cpu time spent up to now is 12.4 secs Computing kpt #: 46 total cpu time spent up to now is 12.6 secs Computing kpt #: 47 total cpu time spent up to now is 12.8 secs Computing kpt #: 48 total cpu time spent up to now is 13.1 secs Computing kpt #: 49 total cpu time spent up to now is 13.3 secs Computing kpt #: 50 total cpu time spent up to now is 13.5 secs Computing kpt #: 51 total cpu time spent up to now is 13.7 secs Computing kpt #: 52 total cpu time spent up to now is 13.9 secs Computing kpt #: 53 total cpu time spent up to now is 14.1 secs Computing kpt #: 54 total cpu time spent up to now is 14.4 secs Computing kpt #: 55 total cpu time spent up to now is 14.6 secs Computing kpt #: 56 total cpu time spent up to now is 14.8 secs Computing kpt #: 57 total cpu time spent up to now is 15.1 secs Computing kpt #: 58 total cpu time spent up to now is 15.3 secs Computing kpt #: 59 total cpu time spent up to now is 15.5 secs Computing kpt #: 60 total cpu time spent up to now is 15.7 secs Computing kpt #: 61 total cpu time spent up to now is 16.0 secs Computing kpt #: 62 total cpu time spent up to now is 16.2 secs Computing kpt #: 63 total cpu time spent up to now is 16.4 secs Computing kpt #: 64 total cpu time spent up to now is 16.6 secs Computing kpt #: 65 total cpu time spent up to now is 16.8 secs Computing kpt #: 66 total cpu time spent up to now is 17.0 secs Computing kpt #: 67 total cpu time spent up to now is 17.3 secs Computing kpt #: 68 total cpu time spent up to now is 17.5 secs Computing kpt #: 69 total cpu time spent up to now is 17.7 secs Computing kpt #: 70 total cpu time spent up to now is 17.9 secs Computing kpt #: 71 total cpu time spent up to now is 18.1 secs Computing kpt #: 72 total cpu time spent up to now is 18.3 secs Computing kpt #: 73 total cpu time spent up to now is 18.5 secs Computing kpt #: 74 total cpu time spent up to now is 18.8 secs Computing kpt #: 75 total cpu time spent up to now is 19.0 secs Computing kpt #: 76 total cpu time spent up to now is 19.2 secs Computing kpt #: 77 total cpu time spent up to now is 19.4 secs Computing kpt #: 78 total cpu time spent up to now is 19.7 secs Computing kpt #: 79 total cpu time spent up to now is 19.9 secs Computing kpt #: 80 total cpu time spent up to now is 20.1 secs Computing kpt #: 81 total cpu time spent up to now is 20.3 secs Computing kpt #: 82 total cpu time spent up to now is 20.6 secs Computing kpt #: 83 total cpu time spent up to now is 20.8 secs Computing kpt #: 84 total cpu time spent up to now is 21.0 secs Computing kpt #: 85 total cpu time spent up to now is 21.3 secs Computing kpt #: 86 total cpu time spent up to now is 21.5 secs Computing kpt #: 87 total cpu time spent up to now is 21.7 secs Computing kpt #: 88 total cpu time spent up to now is 22.0 secs Computing kpt #: 89 total cpu time spent up to now is 22.2 secs Computing kpt #: 90 total cpu time spent up to now is 22.4 secs Computing kpt #: 91 total cpu time spent up to now is 22.7 secs Computing kpt #: 92 total cpu time spent up to now is 22.9 secs Computing kpt #: 93 total cpu time spent up to now is 23.1 secs Computing kpt #: 94 total cpu time spent up to now is 23.3 secs Computing kpt #: 95 total cpu time spent up to now is 23.5 secs Computing kpt #: 96 total cpu time spent up to now is 23.8 secs Computing kpt #: 97 total cpu time spent up to now is 24.0 secs Computing kpt #: 98 total cpu time spent up to now is 24.3 secs Computing kpt #: 99 total cpu time spent up to now is 24.5 secs Computing kpt #: 100 total cpu time spent up to now is 24.7 secs Computing kpt #: 101 total cpu time spent up to now is 25.0 secs Computing kpt #: 102 total cpu time spent up to now is 25.3 secs Computing kpt #: 103 total cpu time spent up to now is 25.5 secs Computing kpt #: 104 total cpu time spent up to now is 25.8 secs Computing kpt #: 105 total cpu time spent up to now is 26.0 secs Computing kpt #: 106 total cpu time spent up to now is 26.3 secs Computing kpt #: 107 total cpu time spent up to now is 26.6 secs Computing kpt #: 108 total cpu time spent up to now is 26.8 secs Computing kpt #: 109 total cpu time spent up to now is 27.1 secs Computing kpt #: 110 total cpu time spent up to now is 27.3 secs Computing kpt #: 111 total cpu time spent up to now is 27.5 secs Computing kpt #: 112 total cpu time spent up to now is 27.8 secs Computing kpt #: 113 total cpu time spent up to now is 28.0 secs Computing kpt #: 114 total cpu time spent up to now is 28.2 secs Computing kpt #: 115 total cpu time spent up to now is 28.5 secs Computing kpt #: 116 total cpu time spent up to now is 28.7 secs Computing kpt #: 117 total cpu time spent up to now is 28.9 secs Computing kpt #: 118 total cpu time spent up to now is 29.2 secs Computing kpt #: 119 total cpu time spent up to now is 29.4 secs Computing kpt #: 120 total cpu time spent up to now is 29.7 secs Computing kpt #: 121 total cpu time spent up to now is 29.9 secs Computing kpt #: 122 total cpu time spent up to now is 30.2 secs Computing kpt #: 123 total cpu time spent up to now is 30.4 secs Computing kpt #: 124 total cpu time spent up to now is 30.7 secs Computing kpt #: 125 total cpu time spent up to now is 30.9 secs Computing kpt #: 126 total cpu time spent up to now is 31.1 secs Computing kpt #: 127 total cpu time spent up to now is 31.4 secs Computing kpt #: 128 total cpu time spent up to now is 31.6 secs Computing kpt #: 129 total cpu time spent up to now is 31.9 secs Computing kpt #: 130 total cpu time spent up to now is 32.1 secs Computing kpt #: 131 total cpu time spent up to now is 32.4 secs Computing kpt #: 132 total cpu time spent up to now is 32.6 secs Computing kpt #: 133 total cpu time spent up to now is 32.9 secs Computing kpt #: 134 total cpu time spent up to now is 33.1 secs Computing kpt #: 135 total cpu time spent up to now is 33.4 secs Computing kpt #: 136 total cpu time spent up to now is 33.6 secs Computing kpt #: 137 total cpu time spent up to now is 33.9 secs Computing kpt #: 138 total cpu time spent up to now is 34.1 secs Computing kpt #: 139 total cpu time spent up to now is 34.4 secs Computing kpt #: 140 total cpu time spent up to now is 34.6 secs Computing kpt #: 141 total cpu time spent up to now is 34.9 secs Computing kpt #: 142 total cpu time spent up to now is 35.1 secs Computing kpt #: 143 total cpu time spent up to now is 35.4 secs Computing kpt #: 144 total cpu time spent up to now is 35.6 secs Computing kpt #: 145 total cpu time spent up to now is 35.9 secs Computing kpt #: 146 total cpu time spent up to now is 36.1 secs Computing kpt #: 147 total cpu time spent up to now is 36.4 secs Computing kpt #: 148 total cpu time spent up to now is 36.6 secs Computing kpt #: 149 total cpu time spent up to now is 36.8 secs Computing kpt #: 150 total cpu time spent up to now is 37.1 secs Computing kpt #: 151 total cpu time spent up to now is 37.3 secs Computing kpt #: 152 total cpu time spent up to now is 37.5 secs Computing kpt #: 153 total cpu time spent up to now is 37.7 secs Computing kpt #: 154 total cpu time spent up to now is 38.0 secs Computing kpt #: 155 total cpu time spent up to now is 38.2 secs Computing kpt #: 156 total cpu time spent up to now is 38.4 secs Computing kpt #: 157 total cpu time spent up to now is 38.6 secs Computing kpt #: 158 total cpu time spent up to now is 38.8 secs Computing kpt #: 159 total cpu time spent up to now is 39.0 secs Computing kpt #: 160 total cpu time spent up to now is 39.3 secs Computing kpt #: 161 total cpu time spent up to now is 39.5 secs Computing kpt #: 162 total cpu time spent up to now is 39.7 secs Computing kpt #: 163 total cpu time spent up to now is 39.9 secs Computing kpt #: 164 total cpu time spent up to now is 40.1 secs Computing kpt #: 165 total cpu time spent up to now is 40.3 secs Computing kpt #: 166 total cpu time spent up to now is 40.6 secs Computing kpt #: 167 total cpu time spent up to now is 40.8 secs Computing kpt #: 168 total cpu time spent up to now is 41.0 secs Computing kpt #: 169 total cpu time spent up to now is 41.2 secs Computing kpt #: 170 total cpu time spent up to now is 41.4 secs Computing kpt #: 171 total cpu time spent up to now is 41.7 secs Computing kpt #: 172 total cpu time spent up to now is 41.9 secs Computing kpt #: 173 total cpu time spent up to now is 42.1 secs Computing kpt #: 174 total cpu time spent up to now is 42.3 secs Computing kpt #: 175 total cpu time spent up to now is 42.6 secs Computing kpt #: 176 total cpu time spent up to now is 42.8 secs Computing kpt #: 177 total cpu time spent up to now is 43.0 secs Computing kpt #: 178 total cpu time spent up to now is 43.3 secs Computing kpt #: 179 total cpu time spent up to now is 43.5 secs Computing kpt #: 180 total cpu time spent up to now is 43.7 secs Computing kpt #: 181 total cpu time spent up to now is 44.0 secs Computing kpt #: 182 total cpu time spent up to now is 44.2 secs Computing kpt #: 183 total cpu time spent up to now is 44.5 secs Computing kpt #: 184 total cpu time spent up to now is 44.7 secs Computing kpt #: 185 total cpu time spent up to now is 45.0 secs Computing kpt #: 186 total cpu time spent up to now is 45.3 secs Computing kpt #: 187 total cpu time spent up to now is 45.6 secs Computing kpt #: 188 total cpu time spent up to now is 45.8 secs Computing kpt #: 189 total cpu time spent up to now is 46.1 secs Computing kpt #: 190 total cpu time spent up to now is 46.4 secs Computing kpt #: 191 total cpu time spent up to now is 46.7 secs Computing kpt #: 192 total cpu time spent up to now is 47.0 secs Computing kpt #: 193 total cpu time spent up to now is 47.3 secs Computing kpt #: 194 total cpu time spent up to now is 47.6 secs Computing kpt #: 195 total cpu time spent up to now is 48.0 secs Computing kpt #: 196 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 48.8 secs Computing kpt #: 197 total cpu time spent up to now is 49.1 secs Computing kpt #: 198 total cpu time spent up to now is 49.3 secs Computing kpt #: 199 total cpu time spent up to now is 49.6 secs Computing kpt #: 200 total cpu time spent up to now is 49.9 secs Computing kpt #: 201 total cpu time spent up to now is 50.1 secs Computing kpt #: 202 total cpu time spent up to now is 50.4 secs Computing kpt #: 203 total cpu time spent up to now is 50.6 secs Computing kpt #: 204 total cpu time spent up to now is 50.8 secs Computing kpt #: 205 total cpu time spent up to now is 51.0 secs Computing kpt #: 206 total cpu time spent up to now is 51.3 secs Computing kpt #: 207 total cpu time spent up to now is 51.5 secs Computing kpt #: 208 total cpu time spent up to now is 51.8 secs Computing kpt #: 209 total cpu time spent up to now is 52.0 secs Computing kpt #: 210 total cpu time spent up to now is 52.2 secs Computing kpt #: 211 total cpu time spent up to now is 52.5 secs Computing kpt #: 212 total cpu time spent up to now is 52.7 secs Computing kpt #: 213 total cpu time spent up to now is 53.0 secs Computing kpt #: 214 total cpu time spent up to now is 53.2 secs Computing kpt #: 215 total cpu time spent up to now is 53.4 secs Computing kpt #: 216 total cpu time spent up to now is 53.7 secs Computing kpt #: 217 total cpu time spent up to now is 54.0 secs Computing kpt #: 218 total cpu time spent up to now is 54.3 secs Computing kpt #: 219 total cpu time spent up to now is 54.6 secs Computing kpt #: 220 total cpu time spent up to now is 54.8 secs Computing kpt #: 221 total cpu time spent up to now is 55.1 secs Computing kpt #: 222 total cpu time spent up to now is 55.4 secs Computing kpt #: 223 total cpu time spent up to now is 55.7 secs Computing kpt #: 224 total cpu time spent up to now is 56.0 secs Computing kpt #: 225 total cpu time spent up to now is 56.3 secs Computing kpt #: 226 total cpu time spent up to now is 56.6 secs Computing kpt #: 227 total cpu time spent up to now is 56.9 secs Computing kpt #: 228 total cpu time spent up to now is 57.2 secs Computing kpt #: 229 total cpu time spent up to now is 57.5 secs Computing kpt #: 230 total cpu time spent up to now is 57.8 secs Computing kpt #: 231 total cpu time spent up to now is 58.0 secs Computing kpt #: 232 total cpu time spent up to now is 58.3 secs Computing kpt #: 233 total cpu time spent up to now is 58.6 secs Computing kpt #: 234 total cpu time spent up to now is 58.8 secs Computing kpt #: 235 total cpu time spent up to now is 59.1 secs Computing kpt #: 236 total cpu time spent up to now is 59.3 secs Computing kpt #: 237 total cpu time spent up to now is 59.6 secs Computing kpt #: 238 total cpu time spent up to now is 59.9 secs Computing kpt #: 239 total cpu time spent up to now is 60.1 secs Computing kpt #: 240 total cpu time spent up to now is 60.4 secs Computing kpt #: 241 total cpu time spent up to now is 60.7 secs Computing kpt #: 242 total cpu time spent up to now is 60.9 secs Computing kpt #: 243 total cpu time spent up to now is 61.1 secs Computing kpt #: 244 total cpu time spent up to now is 61.3 secs Computing kpt #: 245 total cpu time spent up to now is 61.6 secs Computing kpt #: 246 total cpu time spent up to now is 61.9 secs Computing kpt #: 247 total cpu time spent up to now is 62.1 secs Computing kpt #: 248 total cpu time spent up to now is 62.3 secs Computing kpt #: 249 total cpu time spent up to now is 62.5 secs Computing kpt #: 250 total cpu time spent up to now is 62.7 secs Computing kpt #: 251 total cpu time spent up to now is 63.0 secs Computing kpt #: 252 total cpu time spent up to now is 63.2 secs Computing kpt #: 253 total cpu time spent up to now is 63.4 secs Computing kpt #: 254 total cpu time spent up to now is 63.6 secs Computing kpt #: 255 total cpu time spent up to now is 63.9 secs Computing kpt #: 256 total cpu time spent up to now is 64.1 secs Computing kpt #: 257 total cpu time spent up to now is 64.3 secs Computing kpt #: 258 total cpu time spent up to now is 64.5 secs Computing kpt #: 259 total cpu time spent up to now is 64.7 secs Computing kpt #: 260 total cpu time spent up to now is 65.0 secs Computing kpt #: 261 total cpu time spent up to now is 65.2 secs Computing kpt #: 262 total cpu time spent up to now is 65.4 secs Computing kpt #: 263 total cpu time spent up to now is 65.6 secs Computing kpt #: 264 total cpu time spent up to now is 65.8 secs Computing kpt #: 265 total cpu time spent up to now is 66.0 secs Computing kpt #: 266 total cpu time spent up to now is 66.3 secs Computing kpt #: 267 total cpu time spent up to now is 66.5 secs Computing kpt #: 268 total cpu time spent up to now is 66.7 secs Computing kpt #: 269 total cpu time spent up to now is 66.9 secs Computing kpt #: 270 total cpu time spent up to now is 67.2 secs Computing kpt #: 271 total cpu time spent up to now is 67.4 secs Computing kpt #: 272 total cpu time spent up to now is 67.6 secs Computing kpt #: 273 total cpu time spent up to now is 67.8 secs Computing kpt #: 274 total cpu time spent up to now is 68.1 secs Computing kpt #: 275 total cpu time spent up to now is 68.3 secs Computing kpt #: 276 total cpu time spent up to now is 68.5 secs Computing kpt #: 277 total cpu time spent up to now is 68.7 secs Computing kpt #: 278 total cpu time spent up to now is 68.9 secs Computing kpt #: 279 total cpu time spent up to now is 69.1 secs Computing kpt #: 280 total cpu time spent up to now is 69.4 secs Computing kpt #: 281 total cpu time spent up to now is 69.6 secs Computing kpt #: 282 total cpu time spent up to now is 69.8 secs Computing kpt #: 283 total cpu time spent up to now is 70.0 secs Computing kpt #: 284 total cpu time spent up to now is 70.2 secs Computing kpt #: 285 total cpu time spent up to now is 70.5 secs Computing kpt #: 286 total cpu time spent up to now is 70.7 secs Computing kpt #: 287 total cpu time spent up to now is 70.9 secs Computing kpt #: 288 total cpu time spent up to now is 71.1 secs Computing kpt #: 289 total cpu time spent up to now is 71.4 secs Computing kpt #: 290 total cpu time spent up to now is 71.6 secs Computing kpt #: 291 total cpu time spent up to now is 71.8 secs Computing kpt #: 292 total cpu time spent up to now is 72.1 secs Computing kpt #: 293 total cpu time spent up to now is 72.3 secs Computing kpt #: 294 total cpu time spent up to now is 72.5 secs Computing kpt #: 295 total cpu time spent up to now is 72.8 secs Computing kpt #: 296 total cpu time spent up to now is 73.0 secs Computing kpt #: 297 total cpu time spent up to now is 73.3 secs Computing kpt #: 298 total cpu time spent up to now is 73.5 secs Computing kpt #: 299 total cpu time spent up to now is 73.8 secs Computing kpt #: 300 total cpu time spent up to now is 74.0 secs Computing kpt #: 301 total cpu time spent up to now is 74.3 secs Computing kpt #: 302 total cpu time spent up to now is 74.6 secs Computing kpt #: 303 total cpu time spent up to now is 74.8 secs Computing kpt #: 304 total cpu time spent up to now is 75.1 secs Computing kpt #: 305 total cpu time spent up to now is 75.4 secs Computing kpt #: 306 total cpu time spent up to now is 75.6 secs Computing kpt #: 307 total cpu time spent up to now is 75.9 secs Computing kpt #: 308 total cpu time spent up to now is 76.1 secs Computing kpt #: 309 total cpu time spent up to now is 76.3 secs Computing kpt #: 310 total cpu time spent up to now is 76.5 secs Computing kpt #: 311 total cpu time spent up to now is 76.8 secs Computing kpt #: 312 total cpu time spent up to now is 77.0 secs Computing kpt #: 313 total cpu time spent up to now is 77.2 secs Computing kpt #: 314 total cpu time spent up to now is 77.4 secs Computing kpt #: 315 total cpu time spent up to now is 77.6 secs Computing kpt #: 316 total cpu time spent up to now is 77.9 secs Computing kpt #: 317 total cpu time spent up to now is 78.1 secs Computing kpt #: 318 total cpu time spent up to now is 78.3 secs Computing kpt #: 319 total cpu time spent up to now is 78.5 secs Computing kpt #: 320 total cpu time spent up to now is 78.8 secs Computing kpt #: 321 total cpu time spent up to now is 79.0 secs Computing kpt #: 322 total cpu time spent up to now is 79.2 secs Computing kpt #: 323 total cpu time spent up to now is 79.4 secs Computing kpt #: 324 total cpu time spent up to now is 79.7 secs Computing kpt #: 325 total cpu time spent up to now is 79.9 secs Computing kpt #: 326 total cpu time spent up to now is 80.1 secs Computing kpt #: 327 total cpu time spent up to now is 80.3 secs Computing kpt #: 328 total cpu time spent up to now is 80.6 secs Computing kpt #: 329 total cpu time spent up to now is 80.8 secs Computing kpt #: 330 total cpu time spent up to now is 81.0 secs Computing kpt #: 331 total cpu time spent up to now is 81.3 secs Computing kpt #: 332 total cpu time spent up to now is 81.5 secs Computing kpt #: 333 total cpu time spent up to now is 81.7 secs Computing kpt #: 334 total cpu time spent up to now is 81.9 secs Computing kpt #: 335 total cpu time spent up to now is 82.2 secs Computing kpt #: 336 total cpu time spent up to now is 82.4 secs Computing kpt #: 337 total cpu time spent up to now is 82.6 secs Computing kpt #: 338 total cpu time spent up to now is 82.8 secs Computing kpt #: 339 total cpu time spent up to now is 83.0 secs Computing kpt #: 340 total cpu time spent up to now is 83.3 secs Computing kpt #: 341 total cpu time spent up to now is 83.5 secs Computing kpt #: 342 total cpu time spent up to now is 83.7 secs Computing kpt #: 343 total cpu time spent up to now is 83.9 secs Computing kpt #: 344 total cpu time spent up to now is 84.1 secs Computing kpt #: 345 total cpu time spent up to now is 84.4 secs Computing kpt #: 346 total cpu time spent up to now is 84.6 secs Computing kpt #: 347 total cpu time spent up to now is 84.8 secs Computing kpt #: 348 total cpu time spent up to now is 85.0 secs Computing kpt #: 349 total cpu time spent up to now is 85.3 secs Computing kpt #: 350 total cpu time spent up to now is 85.5 secs Computing kpt #: 351 total cpu time spent up to now is 85.7 secs Computing kpt #: 352 total cpu time spent up to now is 85.9 secs Computing kpt #: 353 total cpu time spent up to now is 86.2 secs Computing kpt #: 354 total cpu time spent up to now is 86.4 secs Computing kpt #: 355 total cpu time spent up to now is 86.6 secs Computing kpt #: 356 total cpu time spent up to now is 86.8 secs Computing kpt #: 357 total cpu time spent up to now is 87.1 secs Computing kpt #: 358 total cpu time spent up to now is 87.3 secs Computing kpt #: 359 total cpu time spent up to now is 87.5 secs Computing kpt #: 360 total cpu time spent up to now is 87.7 secs Computing kpt #: 361 total cpu time spent up to now is 88.0 secs Computing kpt #: 362 total cpu time spent up to now is 88.2 secs Computing kpt #: 363 total cpu time spent up to now is 88.4 secs Computing kpt #: 364 total cpu time spent up to now is 88.6 secs Computing kpt #: 365 total cpu time spent up to now is 88.8 secs Computing kpt #: 366 total cpu time spent up to now is 89.0 secs Computing kpt #: 367 total cpu time spent up to now is 89.2 secs Computing kpt #: 368 total cpu time spent up to now is 89.4 secs Computing kpt #: 369 total cpu time spent up to now is 89.7 secs Computing kpt #: 370 total cpu time spent up to now is 89.9 secs Computing kpt #: 371 total cpu time spent up to now is 90.1 secs Computing kpt #: 372 total cpu time spent up to now is 90.3 secs Computing kpt #: 373 total cpu time spent up to now is 90.5 secs Computing kpt #: 374 total cpu time spent up to now is 90.7 secs Computing kpt #: 375 total cpu time spent up to now is 90.9 secs Computing kpt #: 376 total cpu time spent up to now is 91.1 secs Computing kpt #: 377 total cpu time spent up to now is 91.2 secs Computing kpt #: 378 total cpu time spent up to now is 91.4 secs Computing kpt #: 379 total cpu time spent up to now is 91.6 secs Computing kpt #: 380 total cpu time spent up to now is 91.8 secs Computing kpt #: 381 total cpu time spent up to now is 92.0 secs Computing kpt #: 382 total cpu time spent up to now is 92.2 secs Computing kpt #: 383 total cpu time spent up to now is 92.4 secs Computing kpt #: 384 total cpu time spent up to now is 92.6 secs Computing kpt #: 385 total cpu time spent up to now is 92.7 secs Computing kpt #: 386 total cpu time spent up to now is 92.9 secs Computing kpt #: 387 total cpu time spent up to now is 93.1 secs Computing kpt #: 388 total cpu time spent up to now is 93.3 secs Computing kpt #: 389 total cpu time spent up to now is 93.4 secs Computing kpt #: 390 total cpu time spent up to now is 93.6 secs Computing kpt #: 391 total cpu time spent up to now is 93.8 secs Computing kpt #: 392 total cpu time spent up to now is 94.0 secs Computing kpt #: 393 total cpu time spent up to now is 94.2 secs Computing kpt #: 394 total cpu time spent up to now is 94.3 secs Computing kpt #: 395 total cpu time spent up to now is 94.5 secs Computing kpt #: 396 total cpu time spent up to now is 94.7 secs Computing kpt #: 397 total cpu time spent up to now is 94.9 secs Computing kpt #: 398 total cpu time spent up to now is 95.1 secs Computing kpt #: 399 total cpu time spent up to now is 95.3 secs Computing kpt #: 400 total cpu time spent up to now is 95.5 secs Computing kpt #: 401 total cpu time spent up to now is 95.6 secs Computing kpt #: 402 total cpu time spent up to now is 95.8 secs Computing kpt #: 403 total cpu time spent up to now is 96.0 secs Computing kpt #: 404 total cpu time spent up to now is 96.2 secs Computing kpt #: 405 total cpu time spent up to now is 96.4 secs Computing kpt #: 406 total cpu time spent up to now is 96.6 secs Computing kpt #: 407 total cpu time spent up to now is 96.8 secs Computing kpt #: 408 total cpu time spent up to now is 97.0 secs Computing kpt #: 409 total cpu time spent up to now is 97.2 secs Computing kpt #: 410 total cpu time spent up to now is 97.4 secs Computing kpt #: 411 total cpu time spent up to now is 97.7 secs Computing kpt #: 412 total cpu time spent up to now is 97.9 secs Computing kpt #: 413 total cpu time spent up to now is 98.1 secs Computing kpt #: 414 total cpu time spent up to now is 98.3 secs Computing kpt #: 415 total cpu time spent up to now is 98.5 secs Computing kpt #: 416 total cpu time spent up to now is 98.7 secs Computing kpt #: 417 total cpu time spent up to now is 98.9 secs Computing kpt #: 418 total cpu time spent up to now is 99.1 secs Computing kpt #: 419 total cpu time spent up to now is 99.6 secs Computing kpt #: 420 total cpu time spent up to now is 99.8 secs Computing kpt #: 421 total cpu time spent up to now is 100.0 secs Computing kpt #: 422 total cpu time spent up to now is 100.3 secs Computing kpt #: 423 total cpu time spent up to now is 100.5 secs Computing kpt #: 424 total cpu time spent up to now is 100.7 secs Computing kpt #: 425 total cpu time spent up to now is 100.9 secs Computing kpt #: 426 total cpu time spent up to now is 101.2 secs Computing kpt #: 427 total cpu time spent up to now is 101.4 secs Computing kpt #: 428 total cpu time spent up to now is 101.6 secs Computing kpt #: 429 total cpu time spent up to now is 101.9 secs Computing kpt #: 430 total cpu time spent up to now is 102.1 secs Computing kpt #: 431 total cpu time spent up to now is 102.3 secs Computing kpt #: 432 total cpu time spent up to now is 102.6 secs Computing kpt #: 433 total cpu time spent up to now is 102.8 secs Computing kpt #: 434 total cpu time spent up to now is 103.1 secs Computing kpt #: 435 total cpu time spent up to now is 103.3 secs Computing kpt #: 436 total cpu time spent up to now is 103.6 secs Computing kpt #: 437 total cpu time spent up to now is 103.8 secs Computing kpt #: 438 total cpu time spent up to now is 104.1 secs Computing kpt #: 439 total cpu time spent up to now is 104.4 secs Computing kpt #: 440 total cpu time spent up to now is 104.6 secs Computing kpt #: 441 total cpu time spent up to now is 104.9 secs Computing kpt #: 442 total cpu time spent up to now is 105.1 secs Computing kpt #: 443 total cpu time spent up to now is 105.4 secs Computing kpt #: 444 total cpu time spent up to now is 105.6 secs Computing kpt #: 445 total cpu time spent up to now is 105.9 secs Computing kpt #: 446 total cpu time spent up to now is 106.1 secs Computing kpt #: 447 total cpu time spent up to now is 106.3 secs Computing kpt #: 448 total cpu time spent up to now is 106.6 secs Computing kpt #: 449 total cpu time spent up to now is 106.8 secs Computing kpt #: 450 total cpu time spent up to now is 107.0 secs Computing kpt #: 451 total cpu time spent up to now is 107.3 secs Computing kpt #: 452 total cpu time spent up to now is 107.5 secs Computing kpt #: 453 total cpu time spent up to now is 107.7 secs Computing kpt #: 454 total cpu time spent up to now is 108.0 secs Computing kpt #: 455 total cpu time spent up to now is 108.2 secs Computing kpt #: 456 total cpu time spent up to now is 108.4 secs Computing kpt #: 457 total cpu time spent up to now is 108.6 secs Computing kpt #: 458 total cpu time spent up to now is 108.9 secs Computing kpt #: 459 total cpu time spent up to now is 109.1 secs Computing kpt #: 460 total cpu time spent up to now is 109.3 secs Computing kpt #: 461 total cpu time spent up to now is 109.5 secs Computing kpt #: 462 total cpu time spent up to now is 109.7 secs Computing kpt #: 463 total cpu time spent up to now is 110.0 secs Computing kpt #: 464 total cpu time spent up to now is 110.2 secs Computing kpt #: 465 total cpu time spent up to now is 110.4 secs Computing kpt #: 466 total cpu time spent up to now is 110.6 secs Computing kpt #: 467 total cpu time spent up to now is 110.8 secs Computing kpt #: 468 total cpu time spent up to now is 111.0 secs Computing kpt #: 469 total cpu time spent up to now is 111.3 secs Computing kpt #: 470 total cpu time spent up to now is 111.5 secs Computing kpt #: 471 total cpu time spent up to now is 111.7 secs Computing kpt #: 472 total cpu time spent up to now is 111.9 secs Computing kpt #: 473 total cpu time spent up to now is 112.2 secs Computing kpt #: 474 total cpu time spent up to now is 112.4 secs Computing kpt #: 475 total cpu time spent up to now is 112.6 secs Computing kpt #: 476 total cpu time spent up to now is 112.8 secs Computing kpt #: 477 total cpu time spent up to now is 113.1 secs Computing kpt #: 478 total cpu time spent up to now is 113.3 secs Computing kpt #: 479 total cpu time spent up to now is 113.5 secs Computing kpt #: 480 total cpu time spent up to now is 113.7 secs Computing kpt #: 481 total cpu time spent up to now is 114.0 secs Computing kpt #: 482 total cpu time spent up to now is 114.2 secs Computing kpt #: 483 total cpu time spent up to now is 114.4 secs Computing kpt #: 484 total cpu time spent up to now is 114.6 secs Computing kpt #: 485 total cpu time spent up to now is 114.9 secs Computing kpt #: 486 total cpu time spent up to now is 115.1 secs Computing kpt #: 487 total cpu time spent up to now is 115.3 secs Computing kpt #: 488 total cpu time spent up to now is 115.5 secs Computing kpt #: 489 total cpu time spent up to now is 115.7 secs Computing kpt #: 490 total cpu time spent up to now is 116.0 secs Computing kpt #: 491 total cpu time spent up to now is 116.2 secs Computing kpt #: 492 total cpu time spent up to now is 116.4 secs Computing kpt #: 493 total cpu time spent up to now is 116.6 secs Computing kpt #: 494 total cpu time spent up to now is 116.9 secs Computing kpt #: 495 total cpu time spent up to now is 117.1 secs Computing kpt #: 496 total cpu time spent up to now is 117.4 secs Computing kpt #: 497 total cpu time spent up to now is 117.6 secs Computing kpt #: 498 total cpu time spent up to now is 117.9 secs Computing kpt #: 499 total cpu time spent up to now is 118.1 secs Computing kpt #: 500 total cpu time spent up to now is 118.3 secs Computing kpt #: 501 total cpu time spent up to now is 118.5 secs Computing kpt #: 502 total cpu time spent up to now is 118.8 secs Computing kpt #: 503 total cpu time spent up to now is 119.0 secs Computing kpt #: 504 total cpu time spent up to now is 119.2 secs Computing kpt #: 505 total cpu time spent up to now is 119.4 secs Computing kpt #: 506 total cpu time spent up to now is 119.6 secs Computing kpt #: 507 total cpu time spent up to now is 119.9 secs Computing kpt #: 508 total cpu time spent up to now is 120.1 secs Computing kpt #: 509 total cpu time spent up to now is 120.3 secs Computing kpt #: 510 total cpu time spent up to now is 120.6 secs Computing kpt #: 511 total cpu time spent up to now is 120.8 secs Computing kpt #: 512 total cpu time spent up to now is 121.0 secs Computing kpt #: 513 total cpu time spent up to now is 121.2 secs Computing kpt #: 514 total cpu time spent up to now is 121.4 secs Computing kpt #: 515 total cpu time spent up to now is 121.6 secs Computing kpt #: 516 total cpu time spent up to now is 121.8 secs Computing kpt #: 517 total cpu time spent up to now is 122.0 secs Computing kpt #: 518 total cpu time spent up to now is 122.2 secs Computing kpt #: 519 total cpu time spent up to now is 122.4 secs Computing kpt #: 520 total cpu time spent up to now is 122.6 secs Computing kpt #: 521 total cpu time spent up to now is 122.8 secs Computing kpt #: 522 total cpu time spent up to now is 123.0 secs Computing kpt #: 523 total cpu time spent up to now is 123.2 secs Computing kpt #: 524 total cpu time spent up to now is 123.4 secs Computing kpt #: 525 total cpu time spent up to now is 123.6 secs Computing kpt #: 526 total cpu time spent up to now is 123.8 secs Computing kpt #: 527 total cpu time spent up to now is 123.9 secs Computing kpt #: 528 total cpu time spent up to now is 124.1 secs Computing kpt #: 529 total cpu time spent up to now is 124.3 secs ethr = 3.85E-08, avg # of iterations = 18.3 total cpu time spent up to now is 124.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4485 PWs) bands (ev): -37.3576 -37.3576 -12.3882 -12.3882 -10.9266 -10.9266 -0.1641 -0.1641 0.8375 0.8375 2.4063 2.4063 3.4217 3.4217 3.6713 3.6713 4.2407 4.2407 4.7814 4.7814 4.8081 4.8081 5.2190 5.2190 6.1726 6.1726 7.9667 7.9667 11.2459 11.2459 14.0507 14.0507 18.7912 18.7912 k = 0.0078 0.0037-0.0051 ( 4482 PWs) bands (ev): -37.3576 -37.3576 -12.3879 -12.3879 -10.9266 -10.9266 -0.1636 -0.1636 0.8375 0.8375 2.4060 2.4060 3.4210 3.4210 3.6714 3.6714 4.2397 4.2397 4.7813 4.7813 4.8084 4.8084 5.2181 5.2181 6.1714 6.1714 7.9667 7.9667 11.2482 11.2482 14.0536 14.0536 18.7885 18.7885 k = 0.0156 0.0074-0.0102 ( 4483 PWs) bands (ev): -37.3576 -37.3576 -12.3868 -12.3868 -10.9266 -10.9266 -0.1622 -0.1622 0.8375 0.8375 2.4048 2.4048 3.4190 3.4190 3.6716 3.6716 4.2364 4.2364 4.7809 4.7809 4.8094 4.8094 5.2153 5.2153 6.1679 6.1679 7.9668 7.9668 11.2550 11.2550 14.0623 14.0623 18.7804 18.7804 k = 0.0234 0.0111-0.0154 ( 4479 PWs) bands (ev): -37.3575 -37.3575 -12.3850 -12.3850 -10.9266 -10.9266 -0.1599 -0.1599 0.8375 0.8375 2.4030 2.4030 3.4155 3.4155 3.6720 3.6720 4.2312 4.2312 4.7802 4.7802 4.8112 4.8112 5.2108 5.2108 6.1620 6.1620 7.9670 7.9670 11.2663 11.2663 14.0768 14.0768 18.7670 18.7670 k = 0.0312 0.0148-0.0205 ( 4481 PWs) bands (ev): -37.3575 -37.3575 -12.3826 -12.3826 -10.9267 -10.9267 -0.1566 -0.1566 0.8374 0.8374 2.4004 2.4004 3.4106 3.4106 3.6725 3.6725 4.2239 4.2239 4.7791 4.7791 4.8137 4.8137 5.2044 5.2044 6.1539 6.1539 7.9673 7.9673 11.2820 11.2820 14.0970 14.0970 18.7482 18.7482 k = 0.0391 0.0185-0.0256 ( 4485 PWs) bands (ev): -37.3574 -37.3574 -12.3794 -12.3794 -10.9267 -10.9267 -0.1524 -0.1524 0.8373 0.8373 2.3970 2.3970 3.4043 3.4043 3.6731 3.6731 4.2148 4.2148 4.7774 4.7774 4.8170 4.8170 5.1963 5.1963 6.1436 6.1436 7.9676 7.9676 11.3022 11.3022 14.1228 14.1228 18.7241 18.7241 k = 0.0469 0.0222-0.0307 ( 4482 PWs) bands (ev): -37.3574 -37.3574 -12.3755 -12.3755 -10.9267 -10.9267 -0.1473 -0.1473 0.8372 0.8372 2.3930 2.3930 3.3965 3.3965 3.6739 3.6739 4.2040 4.2040 4.7750 4.7750 4.8210 4.8210 5.1865 5.1865 6.1314 6.1314 7.9680 7.9680 11.3268 11.3268 14.1540 14.1540 18.6947 18.6947 k = 0.0547 0.0259-0.0359 ( 4481 PWs) bands (ev): -37.3573 -37.3573 -12.3709 -12.3709 -10.9268 -10.9268 -0.1413 -0.1413 0.8371 0.8371 2.3883 2.3883 3.3871 3.3871 3.6749 3.6749 4.1918 4.1918 4.7721 4.7721 4.8256 4.8256 5.1750 5.1750 6.1173 6.1173 7.9685 7.9685 11.3556 11.3556 14.1906 14.1906 18.6600 18.6600 k = 0.0625 0.0296-0.0410 ( 4491 PWs) bands (ev): -37.3572 -37.3572 -12.3657 -12.3657 -10.9269 -10.9269 -0.1345 -0.1345 0.8370 0.8370 2.3829 2.3829 3.3761 3.3761 3.6760 3.6760 4.1782 4.1782 4.7686 4.7686 4.8306 4.8306 5.1619 5.1619 6.1016 6.1016 7.9691 7.9691 11.3887 11.3887 14.2322 14.2322 18.6202 18.6202 k = 0.0703 0.0333-0.0461 ( 4492 PWs) bands (ev): -37.3571 -37.3571 -12.3597 -12.3597 -10.9269 -10.9269 -0.1268 -0.1268 0.8369 0.8369 2.3768 2.3768 3.3633 3.3633 3.6772 3.6772 4.1636 4.1636 4.7646 4.7646 4.8358 4.8358 5.1474 5.1474 6.0844 6.0844 7.9697 7.9697 11.4258 11.4258 14.2788 14.2788 18.5753 18.5753 k = 0.0781 0.0370-0.0512 ( 4500 PWs) bands (ev): -37.3570 -37.3570 -12.3532 -12.3532 -10.9270 -10.9270 -0.1184 -0.1184 0.8367 0.8367 2.3701 2.3701 3.3488 3.3488 3.6787 3.6787 4.1480 4.1480 4.7600 4.7600 4.8412 4.8412 5.1314 5.1314 6.0660 6.0660 7.9705 7.9705 11.4670 11.4670 14.3301 14.3301 18.5255 18.5255 k = 0.0859 0.0407-0.0563 ( 4505 PWs) bands (ev): -37.3569 -37.3569 -12.3459 -12.3459 -10.9271 -10.9271 -0.1092 -0.1092 0.8365 0.8365 2.3628 2.3628 3.3324 3.3324 3.6803 3.6803 4.1318 4.1318 4.7549 4.7549 4.8465 4.8465 5.1142 5.1142 6.0465 6.0465 7.9712 7.9712 11.5120 11.5120 14.3859 14.3859 18.4708 18.4708 k = 0.0938 0.0444-0.0615 ( 4505 PWs) bands (ev): -37.3567 -37.3567 -12.3380 -12.3380 -10.9272 -10.9272 -0.0993 -0.0993 0.8364 0.8364 2.3549 2.3549 3.3141 3.3141 3.6820 3.6820 4.1150 4.1150 4.7492 4.7492 4.8516 4.8516 5.0958 5.0958 6.0263 6.0263 7.9721 7.9721 11.5608 11.5608 14.4459 14.4459 18.4116 18.4116 k = 0.1016 0.0481-0.0666 ( 4504 PWs) bands (ev): -37.3566 -37.3566 -12.3295 -12.3295 -10.9274 -10.9274 -0.0887 -0.0887 0.8362 0.8362 2.3464 2.3464 3.2938 3.2938 3.6839 3.6839 4.0979 4.0979 4.7431 4.7431 4.8564 4.8564 5.0764 5.0764 6.0055 6.0055 7.9730 7.9730 11.6131 11.6131 14.5098 14.5098 18.3479 18.3479 k = 0.1094 0.0518-0.0717 ( 4506 PWs) bands (ev): -37.3564 -37.3564 -12.3204 -12.3204 -10.9275 -10.9275 -0.0775 -0.0775 0.8359 0.8359 2.3375 2.3375 3.2714 3.2714 3.6860 3.6860 4.0806 4.0806 4.7366 4.7366 4.8606 4.8606 5.0562 5.0562 5.9845 5.9845 7.9740 7.9740 11.6690 11.6690 14.5775 14.5775 18.2801 18.2801 k = 0.1172 0.0556-0.0768 ( 4504 PWs) bands (ev): -37.3562 -37.3562 -12.3106 -12.3106 -10.9276 -10.9276 -0.0657 -0.0657 0.8357 0.8357 2.3281 2.3281 3.2468 3.2468 3.6883 3.6883 4.0634 4.0634 4.7296 4.7296 4.8641 4.8641 5.0354 5.0354 5.9633 5.9633 7.9751 7.9751 11.7281 11.7281 14.6485 14.6485 18.2084 18.2084 k = 0.1250 0.0593-0.0820 ( 4502 PWs) bands (ev): -37.3560 -37.3560 -12.3003 -12.3003 -10.9278 -10.9278 -0.0533 -0.0533 0.8355 0.8355 2.3182 2.3182 3.2201 3.2201 3.6907 3.6907 4.0462 4.0462 4.7222 4.7222 4.8664 4.8664 5.0144 5.0144 5.9423 5.9423 7.9762 7.9762 11.7904 11.7904 14.7227 14.7227 18.1331 18.1331 k = 0.1328 0.0630-0.0871 ( 4499 PWs) bands (ev): -37.3558 -37.3558 -12.2894 -12.2894 -10.9280 -10.9280 -0.0405 -0.0405 0.8352 0.8352 2.3079 2.3079 3.1912 3.1912 3.6932 3.6932 4.0294 4.0294 4.7143 4.7143 4.8671 4.8671 4.9937 4.9937 5.9217 5.9217 7.9775 7.9775 11.8556 11.8556 14.7997 14.7997 18.0546 18.0546 k = 0.1406 0.0667-0.0922 ( 4497 PWs) bands (ev): -37.3556 -37.3556 -12.2780 -12.2780 -10.9282 -10.9282 -0.0273 -0.0273 0.8350 0.8350 2.2972 2.2972 3.1601 3.1601 3.6960 3.6960 4.0129 4.0129 4.7061 4.7061 4.8655 4.8655 4.9742 4.9742 5.9016 5.9016 7.9787 7.9787 11.9236 11.9236 14.8792 14.8792 17.9732 17.9732 k = 0.1484 0.0704-0.0973 ( 4499 PWs) bands (ev): -37.3554 -37.3554 -12.2660 -12.2660 -10.9284 -10.9284 -0.0137 -0.0137 0.8347 0.8347 2.2863 2.2863 3.1267 3.1267 3.6989 3.6989 3.9969 3.9969 4.6975 4.6975 4.8605 4.8605 4.9570 4.9570 5.8824 5.8824 7.9801 7.9801 11.9942 11.9942 14.9610 14.9610 17.8893 17.8893 k = 0.1562 0.0741-0.1024 ( 4501 PWs) bands (ev): -37.3552 -37.3552 -12.2536 -12.2536 -10.9287 -10.9287 0.0002 0.0002 0.8344 0.8344 2.2750 2.2750 3.0913 3.0913 3.7020 3.7020 3.9814 3.9814 4.6885 4.6885 4.8508 4.8508 4.9433 4.9433 5.8641 5.8641 7.9815 7.9815 12.0672 12.0672 15.0446 15.0446 17.8033 17.8033 k = 0.1641 0.0778-0.1076 ( 4505 PWs) bands (ev): -37.3550 -37.3550 -12.2407 -12.2407 -10.9289 -10.9289 0.0143 0.0143 0.8342 0.8342 2.2634 2.2634 3.0537 3.0537 3.7052 3.7052 3.9665 3.9665 4.6791 4.6791 4.8361 4.8361 4.9337 4.9337 5.8470 5.8470 7.9829 7.9829 12.1424 12.1424 15.1298 15.1298 17.7157 17.7157 k = 0.1719 0.0815-0.1127 ( 4507 PWs) bands (ev): -37.3548 -37.3548 -12.2273 -12.2273 -10.9292 -10.9292 0.0286 0.0286 0.8339 0.8339 2.2517 2.2517 3.0142 3.0142 3.7086 3.7086 3.9522 3.9522 4.6694 4.6694 4.8170 4.8170 4.9275 4.9275 5.8312 5.8312 7.9844 7.9844 12.2196 12.2196 15.2161 15.2161 17.6268 17.6268 k = 0.1797 0.0852-0.1178 ( 4499 PWs) bands (ev): -37.3545 -37.3545 -12.2134 -12.2134 -10.9295 -10.9295 0.0430 0.0430 0.8336 0.8336 2.2398 2.2398 2.9727 2.9727 3.7121 3.7121 3.9386 3.9386 4.6594 4.6594 4.7949 4.7949 4.9234 4.9234 5.8168 5.8168 7.9860 7.9860 12.2985 12.2985 15.3032 15.3032 17.5373 17.5373 k = 0.1875 0.0889-0.1229 ( 4491 PWs) bands (ev): -37.3543 -37.3543 -12.1992 -12.1992 -10.9299 -10.9299 0.0574 0.0574 0.8333 0.8333 2.2277 2.2277 2.9295 2.9295 3.7158 3.7158 3.9256 3.9256 4.6491 4.6491 4.7710 4.7710 4.9206 4.9206 5.8040 5.8040 7.9876 7.9876 12.3789 12.3789 15.3906 15.3906 17.4476 17.4476 k = 0.1953 0.0926-0.1280 ( 4494 PWs) bands (ev): -37.3540 -37.3540 -12.1846 -12.1846 -10.9303 -10.9303 0.0719 0.0719 0.8329 0.8329 2.2156 2.2156 2.8847 2.8847 3.7196 3.7196 3.9132 3.9132 4.6385 4.6385 4.7459 4.7459 4.9182 4.9182 5.7928 5.7928 7.9893 7.9893 12.4605 12.4605 15.4779 15.4779 17.3584 17.3584 k = 0.2031 0.0963-0.1332 ( 4490 PWs) bands (ev): -37.3538 -37.3538 -12.1697 -12.1697 -10.9306 -10.9306 0.0862 0.0862 0.8326 0.8326 2.2033 2.2033 2.8385 2.8385 3.7236 3.7236 3.9014 3.9014 4.6275 4.6275 4.7202 4.7202 4.9160 4.9160 5.7834 5.7834 7.9910 7.9910 12.5431 12.5431 15.5644 15.5644 17.2704 17.2704 k = 0.2109 0.1000-0.1383 ( 4488 PWs) bands (ev): -37.3535 -37.3535 -12.1544 -12.1544 -10.9311 -10.9311 0.1004 0.1004 0.8323 0.8323 2.1911 2.1911 2.7909 2.7909 3.7277 3.7277 3.8902 3.8902 4.6161 4.6161 4.6942 4.6942 4.9138 4.9138 5.7758 5.7758 7.9928 7.9928 12.6264 12.6264 15.6494 15.6494 17.1844 17.1844 k = 0.2188 0.1037-0.1434 ( 4486 PWs) bands (ev): -37.3533 -37.3533 -12.1388 -12.1388 -10.9315 -10.9315 0.1143 0.1143 0.8320 0.8320 2.1788 2.1788 2.7422 2.7422 3.7319 3.7319 3.8796 3.8796 4.6043 4.6043 4.6682 4.6682 4.9114 4.9114 5.7701 5.7701 7.9946 7.9946 12.7100 12.7100 15.7321 15.7321 17.1015 17.1015 k = 0.2266 0.1074-0.1485 ( 4487 PWs) bands (ev): -37.3530 -37.3530 -12.1230 -12.1230 -10.9320 -10.9320 0.1280 0.1280 0.8316 0.8316 2.1666 2.1666 2.6926 2.6926 3.7363 3.7363 3.8695 3.8695 4.5919 4.5919 4.6426 4.6426 4.9088 4.9088 5.7662 5.7662 7.9965 7.9965 12.7937 12.7937 15.8110 15.8110 17.0230 17.0230 k = 0.2344 0.1111-0.1537 ( 4487 PWs) bands (ev): -37.3527 -37.3527 -12.1070 -12.1070 -10.9325 -10.9325 0.1414 0.1414 0.8313 0.8313 2.1545 2.1545 2.6422 2.6422 3.7408 3.7408 3.8600 3.8600 4.5784 4.5784 4.6180 4.6180 4.9061 4.9061 5.7641 5.7641 7.9983 7.9983 12.8770 12.8770 15.8848 15.8848 16.9507 16.9507 k = 0.2422 0.1148-0.1588 ( 4487 PWs) bands (ev): -37.3525 -37.3525 -12.0908 -12.0908 -10.9330 -10.9330 0.1544 0.1544 0.8310 0.8310 2.1424 2.1424 2.5911 2.5911 3.7454 3.7454 3.8509 3.8509 4.5630 4.5630 4.5953 4.5953 4.9032 4.9032 5.7639 5.7639 8.0003 8.0003 12.9596 12.9596 15.9509 15.9509 16.8872 16.8872 k = 0.2500 0.1185-0.1639 ( 4490 PWs) bands (ev): -37.3522 -37.3522 -12.0744 -12.0744 -10.9336 -10.9336 0.1670 0.1670 0.8306 0.8306 2.1305 2.1305 2.5397 2.5397 3.7501 3.7501 3.8423 3.8423 4.5444 4.5444 4.5758 4.5758 4.9001 4.9001 5.7656 5.7656 8.0022 8.0022 13.0410 13.0410 16.0064 16.0064 16.8356 16.8356 k = 0.2578 0.1222-0.1690 ( 4482 PWs) bands (ev): -37.3519 -37.3519 -12.0580 -12.0580 -10.9342 -10.9342 0.1791 0.1791 0.8303 0.8303 2.1187 2.1187 2.4880 2.4880 3.7548 3.7548 3.8342 3.8342 4.5228 4.5228 4.5596 4.5596 4.8970 4.8970 5.7690 5.7690 8.0041 8.0041 13.1208 13.1208 16.0476 16.0476 16.7998 16.7998 k = 0.2656 0.1259-0.1741 ( 4482 PWs) bands (ev): -37.3517 -37.3517 -12.0414 -12.0414 -10.9348 -10.9348 0.1906 0.1906 0.8300 0.8300 2.1070 2.1070 2.4363 2.4363 3.7597 3.7597 3.8265 3.8265 4.4994 4.4994 4.5455 4.5455 4.8939 4.8939 5.7742 5.7742 8.0061 8.0061 13.1985 13.1985 16.0714 16.0714 16.7834 16.7834 k = 0.2734 0.1296-0.1793 ( 4474 PWs) bands (ev): -37.3514 -37.3514 -12.0248 -12.0248 -10.9355 -10.9355 0.2017 0.2017 0.8296 0.8296 2.0955 2.0955 2.3848 2.3848 3.7645 3.7645 3.8193 3.8193 4.4753 4.4753 4.5323 4.5323 4.8907 4.8907 5.7811 5.7811 8.0081 8.0081 13.2733 13.2733 16.0766 16.0766 16.7876 16.7876 k = 0.2812 0.1333-0.1844 ( 4477 PWs) bands (ev): -37.3511 -37.3511 -12.0083 -12.0083 -10.9361 -10.9361 0.2121 0.2121 0.8293 0.8293 2.0841 2.0841 2.3335 2.3335 3.7693 3.7693 3.8126 3.8126 4.4511 4.4511 4.5197 4.5197 4.8877 4.8877 5.7895 5.7895 8.0101 8.0101 13.3448 13.3448 16.0656 16.0656 16.8106 16.8106 k = 0.2891 0.1370-0.1895 ( 4478 PWs) bands (ev): -37.3509 -37.3509 -11.9917 -11.9917 -10.9368 -10.9368 0.2220 0.2220 0.8290 0.8290 2.0729 2.0729 2.2828 2.2828 3.7739 3.7739 3.8065 3.8065 4.4271 4.4271 4.5074 4.5074 4.8847 4.8847 5.7995 5.7995 8.0121 8.0121 13.4123 13.4123 16.0431 16.0431 16.8479 16.8479 k = 0.2969 0.1407-0.1946 ( 4478 PWs) bands (ev): -37.3506 -37.3506 -11.9753 -11.9753 -10.9376 -10.9376 0.2312 0.2312 0.8286 0.8286 2.0616 2.0616 2.2330 2.2330 3.7778 3.7778 3.8015 3.8015 4.4034 4.4034 4.4953 4.4953 4.8819 4.8819 5.8110 5.8110 8.0140 8.0140 13.4750 13.4750 16.0143 16.0143 16.8949 16.8949 k = 0.3047 0.1444-0.1998 ( 4476 PWs) bands (ev): -37.3504 -37.3504 -11.9589 -11.9589 -10.9383 -10.9383 0.2398 0.2398 0.8283 0.8283 2.0500 2.0500 2.1843 2.1843 3.7803 3.7803 3.7984 3.7984 4.3801 4.3801 4.4834 4.4834 4.8793 4.8793 5.8238 5.8238 8.0160 8.0160 13.5322 13.5322 15.9838 15.9838 16.9473 16.9473 k = 0.3125 0.1481-0.2049 ( 4475 PWs) bands (ev): -37.3501 -37.3501 -11.9428 -11.9428 -10.9391 -10.9391 0.2478 0.2478 0.8280 0.8280 2.0378 2.0378 2.1375 2.1375 3.7797 3.7797 3.7987 3.7987 4.3574 4.3574 4.4717 4.4717 4.8769 4.8769 5.8378 5.8378 8.0180 8.0180 13.5831 13.5831 15.9549 15.9549 17.0023 17.0023 k = 0.3203 0.1518-0.2100 ( 4479 PWs) bands (ev): -37.3499 -37.3499 -11.9268 -11.9268 -10.9399 -10.9399 0.2552 0.2552 0.8276 0.8276 2.0232 2.0232 2.0943 2.0943 3.7766 3.7766 3.8018 3.8018 4.3351 4.3351 4.4601 4.4601 4.8747 4.8747 5.8530 5.8530 8.0199 8.0199 13.6271 13.6271 15.9302 15.9302 17.0576 17.0576 k = 0.3281 0.1555-0.2151 ( 4475 PWs) bands (ev): -37.3496 -37.3496 -11.9111 -11.9111 -10.9408 -10.9408 0.2619 0.2619 0.8273 0.8273 2.0023 2.0023 2.0588 2.0588 3.7725 3.7725 3.8062 3.8062 4.3135 4.3135 4.4487 4.4487 4.8727 4.8727 5.8692 5.8692 8.0218 8.0218 13.6637 13.6637 15.9116 15.9116 17.1118 17.1118 k = 0.3359 0.1592-0.2202 ( 4475 PWs) bands (ev): -37.3494 -37.3494 -11.8957 -11.8957 -10.9416 -10.9416 0.2681 0.2681 0.8270 0.8270 1.9708 1.9708 2.0355 2.0355 3.7683 3.7683 3.8112 3.8112 4.2925 4.2925 4.4375 4.4375 4.8710 4.8710 5.8863 5.8863 8.0237 8.0237 13.6923 13.6923 15.9004 15.9004 17.1635 17.1635 k = 0.3438 0.1629-0.2254 ( 4473 PWs) bands (ev): -37.3492 -37.3492 -11.8806 -11.8806 -10.9424 -10.9424 0.2736 0.2736 0.8267 0.8267 1.9323 1.9323 2.0209 2.0209 3.7641 3.7641 3.8164 3.8164 4.2722 4.2722 4.4264 4.4264 4.8695 4.8695 5.9042 5.9042 8.0255 8.0255 13.7128 13.7128 15.8973 15.8973 17.2120 17.2120 k = 0.3516 0.1667-0.2305 ( 4473 PWs) bands (ev): -37.3490 -37.3490 -11.8660 -11.8660 -10.9433 -10.9433 0.2786 0.2786 0.8264 0.8264 1.8919 1.8919 2.0099 2.0099 3.7601 3.7601 3.8217 3.8217 4.2525 4.2525 4.4157 4.4157 4.8682 4.8682 5.9228 5.9228 8.0273 8.0273 13.7253 13.7253 15.9028 15.9028 17.2563 17.2563 k = 0.3594 0.1704-0.2356 ( 4473 PWs) bands (ev): -37.3488 -37.3488 -11.8517 -11.8517 -10.9442 -10.9442 0.2830 0.2830 0.8261 0.8261 1.8518 1.8518 2.0006 2.0006 3.7563 3.7563 3.8270 3.8270 4.2336 4.2336 4.4052 4.4052 4.8672 4.8672 5.9418 5.9418 8.0290 8.0290 13.7302 13.7302 15.9168 15.9168 17.2959 17.2959 k = 0.3672 0.1741-0.2407 ( 4475 PWs) bands (ev): -37.3486 -37.3486 -11.8379 -11.8379 -10.9451 -10.9451 0.2870 0.2870 0.8258 0.8258 1.8126 1.8126 1.9923 1.9923 3.7528 3.7528 3.8324 3.8324 4.2155 4.2155 4.3950 4.3950 4.8664 4.8664 5.9612 5.9612 8.0307 8.0307 13.7279 13.7279 15.9392 15.9392 17.3302 17.3302 k = 0.3750 0.1778-0.2459 ( 4474 PWs) bands (ev): -37.3484 -37.3484 -11.8246 -11.8246 -10.9459 -10.9459 0.2904 0.2904 0.8255 0.8255 1.7749 1.7749 1.9847 1.9847 3.7495 3.7495 3.8377 3.8377 4.1981 4.1981 4.3851 4.3851 4.8658 4.8658 5.9807 5.9807 8.0323 8.0323 13.7193 13.7193 15.9694 15.9694 17.3586 17.3586 k = 0.3828 0.1815-0.2510 ( 4476 PWs) bands (ev): -37.3482 -37.3482 -11.8119 -11.8119 -10.9468 -10.9468 0.2934 0.2934 0.8252 0.8252 1.7389 1.7389 1.9778 1.9778 3.7465 3.7465 3.8429 3.8429 4.1815 4.1815 4.3755 4.3755 4.8653 4.8653 6.0003 6.0003 8.0339 8.0339 13.7053 13.7053 16.0066 16.0066 17.3807 17.3807 k = 0.3906 0.1852-0.2561 ( 4477 PWs) bands (ev): -37.3480 -37.3480 -11.7998 -11.7998 -10.9476 -10.9476 0.2960 0.2960 0.8250 0.8250 1.7046 1.7046 1.9713 1.9713 3.7437 3.7437 3.8480 3.8480 4.1658 4.1658 4.3664 4.3664 4.8650 4.8650 6.0197 6.0197 8.0354 8.0354 13.6869 13.6869 16.0500 16.0500 17.3959 17.3959 k = 0.3984 0.1889-0.2612 ( 4475 PWs) bands (ev): -37.3478 -37.3478 -11.7883 -11.7883 -10.9485 -10.9485 0.2983 0.2983 0.8247 0.8247 1.6722 1.6722 1.9653 1.9653 3.7412 3.7412 3.8531 3.8531 4.1510 4.1510 4.3577 4.3577 4.8649 4.8649 6.0388 6.0388 8.0368 8.0368 13.6652 13.6652 16.0987 16.0987 17.4039 17.4039 k = 0.4062 0.1926-0.2663 ( 4473 PWs) bands (ev): -37.3477 -37.3477 -11.7775 -11.7775 -10.9493 -10.9493 0.3002 0.3002 0.8245 0.8245 1.6419 1.6419 1.9598 1.9598 3.7389 3.7389 3.8579 3.8579 4.1370 4.1370 4.3494 4.3494 4.8648 4.8648 6.0574 6.0574 8.0381 8.0381 13.6412 13.6412 16.1520 16.1520 17.4044 17.4044 k = 0.4141 0.1963-0.2715 ( 4476 PWs) bands (ev): -37.3475 -37.3475 -11.7674 -11.7674 -10.9500 -10.9500 0.3018 0.3018 0.8243 0.8243 1.6137 1.6137 1.9547 1.9547 3.7369 3.7369 3.8626 3.8626 4.1240 4.1240 4.3415 4.3415 4.8649 4.8649 6.0754 6.0754 8.0393 8.0393 13.6158 13.6158 16.2090 16.2090 17.3973 17.3973 k = 0.4219 0.2000-0.2766 ( 4477 PWs) bands (ev): -37.3474 -37.3474 -11.7580 -11.7580 -10.9508 -10.9508 0.3031 0.3031 0.8241 0.8241 1.5877 1.5877 1.9501 1.9501 3.7352 3.7352 3.8671 3.8671 4.1120 4.1120 4.3343 4.3343 4.8650 4.8650 6.0925 6.0925 8.0405 8.0405 13.5899 13.5899 16.2690 16.2690 17.3827 17.3827 k = 0.4297 0.2037-0.2817 ( 4480 PWs) bands (ev): -37.3473 -37.3473 -11.7495 -11.7495 -10.9514 -10.9514 0.3042 0.3042 0.8239 0.8239 1.5639 1.5639 1.9459 1.9459 3.7336 3.7336 3.8713 3.8713 4.1009 4.1009 4.3275 4.3275 4.8652 4.8652 6.1085 6.1085 8.0415 8.0415 13.5642 13.5642 16.3313 16.3313 17.3608 17.3608 k = 0.4375 0.2074-0.2868 ( 4482 PWs) bands (ev): -37.3472 -37.3472 -11.7417 -11.7417 -10.9521 -10.9521 0.3051 0.3051 0.8238 0.8238 1.5425 1.5425 1.9422 1.9422 3.7323 3.7323 3.8752 3.8752 4.0908 4.0908 4.3214 4.3214 4.8654 4.8654 6.1234 6.1234 8.0425 8.0425 13.5395 13.5395 16.3952 16.3952 17.3321 17.3321 k = 0.4453 0.2111-0.2920 ( 4477 PWs) bands (ev): -37.3471 -37.3471 -11.7348 -11.7348 -10.9527 -10.9527 0.3058 0.3058 0.8236 0.8236 1.5234 1.5234 1.9389 1.9389 3.7312 3.7312 3.8788 3.8788 4.0819 4.0819 4.3158 4.3158 4.8656 4.8656 6.1370 6.1370 8.0433 8.0433 13.5163 13.5163 16.4603 16.4603 17.2972 17.2972 k = 0.4531 0.2148-0.2971 ( 4476 PWs) bands (ev): -37.3470 -37.3470 -11.7287 -11.7287 -10.9532 -10.9532 0.3064 0.3064 0.8235 0.8235 1.5068 1.5068 1.9360 1.9360 3.7302 3.7302 3.8821 3.8821 4.0740 4.0740 4.3110 4.3110 4.8658 4.8658 6.1490 6.1490 8.0441 8.0441 13.4952 13.4952 16.5261 16.5261 17.2568 17.2568 k = 0.4609 0.2185-0.3022 ( 4470 PWs) bands (ev): -37.3469 -37.3469 -11.7235 -11.7235 -10.9536 -10.9536 0.3069 0.3069 0.8234 0.8234 1.4927 1.4927 1.9336 1.9336 3.7294 3.7294 3.8849 3.8849 4.0672 4.0672 4.3068 4.3068 4.8660 4.8660 6.1595 6.1595 8.0447 8.0447 13.4766 13.4766 16.5919 16.5919 17.2118 17.2118 k = 0.4688 0.2222-0.3073 ( 4475 PWs) bands (ev): -37.3469 -37.3469 -11.7193 -11.7193 -10.9540 -10.9540 0.3072 0.3072 0.8233 0.8233 1.4811 1.4811 1.9316 1.9316 3.7288 3.7288 3.8873 3.8873 4.0616 4.0616 4.3033 4.3033 4.8662 4.8662 6.1682 6.1682 8.0452 8.0452 13.4610 13.4610 16.6572 16.6572 17.1629 17.1629 k = 0.4766 0.2259-0.3124 ( 4476 PWs) bands (ev): -37.3468 -37.3468 -11.7160 -11.7160 -10.9543 -10.9543 0.3075 0.3075 0.8232 0.8232 1.4720 1.4720 1.9301 1.9301 3.7284 3.7284 3.8892 3.8892 4.0572 4.0572 4.3006 4.3006 4.8664 4.8664 6.1751 6.1751 8.0456 8.0456 13.4485 13.4485 16.7213 16.7213 17.1114 17.1114 k = 0.4844 0.2296-0.3176 ( 4481 PWs) bands (ev): -37.3468 -37.3468 -11.7136 -11.7136 -10.9545 -10.9545 0.3076 0.3076 0.8232 0.8232 1.4655 1.4655 1.9290 1.9290 3.7280 3.7280 3.8906 3.8906 4.0540 4.0540 4.2986 4.2986 4.8665 4.8665 6.1800 6.1800 8.0459 8.0459 13.4394 13.4394 16.7827 16.7827 17.0588 17.0588 k = 0.4922 0.2333-0.3227 ( 4479 PWs) bands (ev): -37.3468 -37.3468 -11.7121 -11.7121 -10.9546 -10.9546 0.3077 0.3077 0.8231 0.8231 1.4616 1.4616 1.9283 1.9283 3.7278 3.7278 3.8914 3.8914 4.0521 4.0521 4.2974 4.2974 4.8666 4.8666 6.1831 6.1831 8.0461 8.0461 13.4339 13.4339 16.8369 16.8369 17.0098 17.0098 k = 0.5000 0.2370-0.3278 ( 4482 PWs) bands (ev): -37.3468 -37.3468 -11.7117 -11.7117 -10.9547 -10.9547 0.3078 0.3078 0.8231 0.8231 1.4603 1.4603 1.9281 1.9281 3.7278 3.7278 3.8917 3.8917 4.0515 4.0515 4.2970 4.2970 4.8666 4.8666 6.1841 6.1841 8.0462 8.0462 13.4320 13.4320 16.8644 16.8644 16.9840 16.9840 k = 0.5000 0.2370-0.3278 ( 4482 PWs) bands (ev): -37.3468 -37.3468 -11.7117 -11.7117 -10.9547 -10.9547 0.3078 0.3078 0.8231 0.8231 1.4603 1.4603 1.9281 1.9281 3.7278 3.7278 3.8917 3.8917 4.0515 4.0515 4.2970 4.2970 4.8666 4.8666 6.1841 6.1841 8.0462 8.0462 13.4320 13.4320 16.8644 16.8644 16.9840 16.9840 k = 0.5001 0.2371-0.3276 ( 4480 PWs) bands (ev): -37.3468 -37.3468 -11.7117 -11.7117 -10.9547 -10.9547 0.3078 0.3078 0.8231 0.8231 1.4603 1.4603 1.9281 1.9281 3.7278 3.7278 3.8917 3.8917 4.0515 4.0515 4.2970 4.2970 4.8666 4.8666 6.1841 6.1841 8.0462 8.0462 13.4320 13.4320 16.8644 16.8644 16.9840 16.9840 k = 0.5001 0.2371-0.3276 ( 4480 PWs) bands (ev): -37.3468 -37.3468 -11.7117 -11.7117 -10.9547 -10.9547 0.3078 0.3078 0.8231 0.8231 1.4603 1.4603 1.9281 1.9281 3.7278 3.7278 3.8917 3.8917 4.0515 4.0515 4.2970 4.2970 4.8666 4.8666 6.1841 6.1841 8.0462 8.0462 13.4320 13.4320 16.8644 16.8644 16.9840 16.9840 k = 0.5001 0.2371-0.3176 ( 4478 PWs) bands (ev): -37.3468 -37.3468 -11.7123 -11.7123 -10.9538 -10.9538 0.3071 0.3071 0.8230 0.8230 1.4606 1.4606 1.9276 1.9276 3.7277 3.7277 3.8917 3.8917 4.0526 4.0526 4.2976 4.2976 4.8671 4.8671 6.1832 6.1832 8.0456 8.0456 13.4325 13.4325 16.8256 16.8256 17.0238 17.0238 k = 0.5001 0.2371-0.3077 ( 4480 PWs) bands (ev): -37.3468 -37.3468 -11.7143 -11.7143 -10.9514 -10.9514 0.3053 0.3053 0.8226 0.8226 1.4614 1.4614 1.9262 1.9262 3.7273 3.7273 3.8915 3.8915 4.0561 4.0561 4.2992 4.2992 4.8684 4.8684 6.1808 6.1808 8.0439 8.0439 13.4338 13.4338 16.7586 16.7586 17.0935 17.0935 k = 0.5001 0.2371-0.2978 ( 4480 PWs) bands (ev): -37.3468 -37.3468 -11.7176 -11.7176 -10.9475 -10.9475 0.3023 0.3023 0.8218 0.8218 1.4627 1.4627 1.9238 1.9238 3.7268 3.7268 3.8911 3.8911 4.0618 4.0618 4.3018 4.3018 4.8705 4.8705 6.1767 6.1767 8.0411 8.0411 13.4362 13.4362 16.6871 16.6871 17.1694 17.1694 k = 0.5001 0.2371-0.2878 ( 4478 PWs) bands (ev): -37.3468 -37.3468 -11.7220 -11.7220 -10.9421 -10.9421 0.2982 0.2982 0.8209 0.8209 1.4644 1.4644 1.9205 1.9205 3.7261 3.7261 3.8907 3.8907 4.0697 4.0697 4.3054 4.3054 4.8735 4.8735 6.1710 6.1710 8.0373 8.0373 13.4395 13.4395 16.6150 16.6150 17.2474 17.2474 k = 0.5001 0.2371-0.2779 ( 4476 PWs) bands (ev): -37.3468 -37.3468 -11.7276 -11.7276 -10.9354 -10.9354 0.2930 0.2930 0.8196 0.8196 1.4667 1.4667 1.9163 1.9163 3.7253 3.7253 3.8903 3.8903 4.0798 4.0798 4.3100 4.3100 4.8772 4.8772 6.1637 6.1637 8.0324 8.0324 13.4438 13.4438 16.5434 16.5434 17.3262 17.3262 k = 0.5001 0.2371-0.2680 ( 4476 PWs) bands (ev): -37.3468 -37.3468 -11.7341 -11.7341 -10.9275 -10.9275 0.2867 0.2867 0.8181 0.8181 1.4693 1.4693 1.9112 1.9112 3.7242 3.7242 3.8898 3.8898 4.0920 4.0920 4.3156 4.3156 4.8816 4.8816 6.1548 6.1548 8.0265 8.0265 13.4492 13.4492 16.4727 16.4727 17.4054 17.4054 k = 0.5001 0.2371-0.2580 ( 4473 PWs) bands (ev): -37.3468 -37.3468 -11.7415 -11.7415 -10.9184 -10.9184 0.2795 0.2795 0.8164 0.8164 1.4723 1.4723 1.9054 1.9054 3.7231 3.7231 3.8893 3.8893 4.1063 4.1063 4.3220 4.3220 4.8866 4.8866 6.1441 6.1441 8.0197 8.0197 13.4557 13.4557 16.4030 16.4030 17.4845 17.4845 k = 0.5001 0.2371-0.2481 ( 4472 PWs) bands (ev): -37.3468 -37.3468 -11.7497 -11.7497 -10.9083 -10.9083 0.2715 0.2715 0.8144 0.8144 1.4756 1.4756 1.8988 1.8988 3.7219 3.7219 3.8888 3.8888 4.1226 4.1226 4.3293 4.3293 4.8922 4.8922 6.1318 6.1318 8.0120 8.0120 13.4635 13.4635 16.3344 16.3344 17.5628 17.5628 k = 0.5001 0.2371-0.2382 ( 4476 PWs) bands (ev): -37.3468 -37.3468 -11.7585 -11.7585 -10.8974 -10.8974 0.2626 0.2626 0.8123 0.8123 1.4793 1.4793 1.8915 1.8915 3.7206 3.7206 3.8884 3.8884 4.1409 4.1409 4.3374 4.3374 4.8983 4.8983 6.1179 6.1179 8.0034 8.0034 13.4724 13.4724 16.2669 16.2669 17.6399 17.6399 k = 0.5001 0.2371-0.2282 ( 4472 PWs) bands (ev): -37.3468 -37.3468 -11.7679 -11.7679 -10.8858 -10.8858 0.2531 0.2531 0.8100 0.8100 1.4831 1.4831 1.8836 1.8836 3.7193 3.7193 3.8880 3.8880 4.1612 4.1612 4.3463 4.3463 4.9048 4.9048 6.1022 6.1022 7.9941 7.9941 13.4827 13.4827 16.2007 16.2007 17.7149 17.7149 k = 0.5001 0.2371-0.2183 ( 4464 PWs) bands (ev): -37.3468 -37.3468 -11.7776 -11.7776 -10.8737 -10.8737 0.2430 0.2430 0.8075 0.8075 1.4871 1.4871 1.8751 1.8751 3.7180 3.7180 3.8876 3.8876 4.1833 4.1833 4.3558 4.3558 4.9117 4.9117 6.0848 6.0848 7.9841 7.9841 13.4943 13.4943 16.1356 16.1356 17.7869 17.7869 k = 0.5001 0.2371-0.2084 ( 4458 PWs) bands (ev): -37.3468 -37.3468 -11.7877 -11.7877 -10.8611 -10.8611 0.2325 0.2325 0.8050 0.8050 1.4912 1.4912 1.8662 1.8662 3.7166 3.7166 3.8873 3.8873 4.2072 4.2072 4.3659 4.3659 4.9187 4.9187 6.0658 6.0658 7.9734 7.9734 13.5074 13.5074 16.0718 16.0718 17.8546 17.8546 k = 0.5001 0.2371-0.1984 ( 4458 PWs) bands (ev): -37.3468 -37.3468 -11.7978 -11.7978 -10.8483 -10.8483 0.2215 0.2215 0.8023 0.8023 1.4955 1.4955 1.8569 1.8569 3.7153 3.7153 3.8870 3.8870 4.2328 4.2328 4.3765 4.3765 4.9260 4.9260 6.0451 6.0451 7.9623 7.9623 13.5218 13.5218 16.0092 16.0092 17.9162 17.9162 k = 0.5001 0.2370-0.1885 ( 4464 PWs) bands (ev): -37.3468 -37.3468 -11.8081 -11.8081 -10.8353 -10.8353 0.2103 0.2103 0.7995 0.7995 1.4997 1.4997 1.8473 1.8473 3.7140 3.7140 3.8867 3.8867 4.2601 4.2601 4.3876 4.3876 4.9333 4.9333 6.0228 6.0228 7.9507 7.9507 13.5377 13.5377 15.9478 15.9478 17.9699 17.9699 k = 0.5001 0.2370-0.1786 ( 4464 PWs) bands (ev): -37.3468 -37.3468 -11.8183 -11.8183 -10.8222 -10.8222 0.1989 0.1989 0.7967 0.7967 1.5039 1.5039 1.8375 1.8375 3.7127 3.7127 3.8865 3.8865 4.2888 4.2888 4.3992 4.3992 4.9406 4.9406 5.9989 5.9989 7.9389 7.9389 13.5550 13.5550 15.8876 15.8876 18.0142 18.0142 k = 0.5001 0.2370-0.1686 ( 4464 PWs) bands (ev): -37.3468 -37.3468 -11.8284 -11.8284 -10.8093 -10.8093 0.1875 0.1875 0.7938 0.7938 1.5081 1.5081 1.8276 1.8276 3.7115 3.7115 3.8863 3.8863 4.3189 4.3189 4.4111 4.4111 4.9479 4.9479 5.9734 5.9734 7.9268 7.9268 13.5737 13.5737 15.8287 15.8287 18.0488 18.0488 k = 0.5001 0.2370-0.1587 ( 4466 PWs) bands (ev): -37.3468 -37.3468 -11.8383 -11.8383 -10.7965 -10.7965 0.1761 0.1761 0.7910 0.7910 1.5122 1.5122 1.8176 1.8176 3.7104 3.7104 3.8862 3.8862 4.3499 4.3499 4.4235 4.4235 4.9551 4.9551 5.9465 5.9465 7.9146 7.9146 13.5938 13.5938 15.7712 15.7712 18.0749 18.0749 k = 0.5001 0.2370-0.1488 ( 4468 PWs) bands (ev): -37.3468 -37.3468 -11.8480 -11.8480 -10.7840 -10.7840 0.1649 0.1649 0.7882 0.7882 1.5162 1.5162 1.8077 1.8077 3.7093 3.7093 3.8861 3.8861 4.3813 4.3813 4.4368 4.4368 4.9620 4.9620 5.9182 5.9182 7.9023 7.9023 13.6151 13.6151 15.7150 15.7150 18.0943 18.0943 k = 0.5001 0.2370-0.1388 ( 4474 PWs) bands (ev): -37.3468 -37.3468 -11.8572 -11.8572 -10.7719 -10.7719 0.1539 0.1539 0.7854 0.7854 1.5201 1.5201 1.7980 1.7980 3.7083 3.7083 3.8860 3.8860 4.4117 4.4117 4.4523 4.4523 4.9687 4.9687 5.8888 5.8888 7.8902 7.8902 13.6375 13.6375 15.6603 15.6603 18.1088 18.1088 k = 0.5001 0.2370-0.1289 ( 4478 PWs) bands (ev): -37.3468 -37.3468 -11.8661 -11.8661 -10.7603 -10.7603 0.1432 0.1432 0.7827 0.7827 1.5237 1.5237 1.7885 1.7885 3.7074 3.7074 3.8859 3.8859 4.4372 4.4372 4.4731 4.4731 4.9751 4.9751 5.8582 5.8582 7.8784 7.8784 13.6608 13.6608 15.6072 15.6072 18.1198 18.1198 k = 0.5000 0.2370-0.1190 ( 4474 PWs) bands (ev): -37.3468 -37.3468 -11.8745 -11.8745 -10.7491 -10.7491 0.1330 0.1330 0.7801 0.7801 1.5272 1.5272 1.7793 1.7793 3.7065 3.7065 3.8858 3.8858 4.4553 4.4553 4.5018 4.5018 4.9812 4.9812 5.8268 5.8268 7.8668 7.8668 13.6850 13.6850 15.5560 15.5560 18.1284 18.1284 k = 0.5000 0.2370-0.1090 ( 4476 PWs) bands (ev): -37.3468 -37.3468 -11.8825 -11.8825 -10.7387 -10.7387 0.1233 0.1233 0.7776 0.7776 1.5305 1.5305 1.7706 1.7706 3.7057 3.7057 3.8857 3.8857 4.4688 4.4688 4.5352 4.5352 4.9868 4.9868 5.7946 5.7946 7.8557 7.8557 13.7096 13.7096 15.5066 15.5066 18.1353 18.1353 k = 0.5000 0.2370-0.0991 ( 4484 PWs) bands (ev): -37.3468 -37.3468 -11.8898 -11.8898 -10.7289 -10.7289 0.1141 0.1141 0.7753 0.7753 1.5335 1.5335 1.7623 1.7623 3.7050 3.7050 3.8857 3.8857 4.4802 4.4802 4.5702 4.5702 4.9920 4.9920 5.7622 5.7622 7.8451 7.8451 13.7343 13.7343 15.4595 15.4595 18.1408 18.1408 k = 0.5000 0.2370-0.0892 ( 4492 PWs) bands (ev): -37.3468 -37.3468 -11.8966 -11.8966 -10.7198 -10.7198 0.1056 0.1056 0.7731 0.7731 1.5363 1.5363 1.7546 1.7546 3.7043 3.7043 3.8857 3.8857 4.4903 4.4903 4.6057 4.6057 4.9967 4.9967 5.7297 5.7297 7.8352 7.8352 13.7590 13.7590 15.4149 15.4149 18.1454 18.1454 k = 0.5000 0.2370-0.0792 ( 4491 PWs) bands (ev): -37.3468 -37.3468 -11.9028 -11.9028 -10.7116 -10.7116 0.0978 0.0978 0.7711 0.7711 1.5389 1.5389 1.7475 1.7475 3.7037 3.7037 3.8856 3.8856 4.4994 4.4994 4.6408 4.6408 5.0010 5.0010 5.6975 5.6975 7.8260 7.8260 13.7831 13.7831 15.3732 15.3732 18.1492 18.1492 k = 0.5000 0.2370-0.0693 ( 4490 PWs) bands (ev): -37.3468 -37.3468 -11.9083 -11.9083 -10.7042 -10.7042 0.0908 0.0908 0.7693 0.7693 1.5412 1.5412 1.7410 1.7410 3.7032 3.7032 3.8856 3.8856 4.5076 4.5076 4.6750 4.6750 5.0046 5.0046 5.6663 5.6663 7.8177 7.8177 13.8061 13.8061 15.3347 15.3347 18.1524 18.1524 k = 0.5000 0.2370-0.0594 ( 4490 PWs) bands (ev): -37.3468 -37.3468 -11.9131 -11.9131 -10.6977 -10.6977 0.0846 0.0846 0.7677 0.7677 1.5432 1.5432 1.7353 1.7353 3.7028 3.7028 3.8856 3.8856 4.5147 4.5147 4.7074 4.7074 5.0077 5.0077 5.6366 5.6366 7.8103 7.8103 13.8277 13.8277 15.2999 15.2999 18.1551 18.1551 k = 0.5000 0.2370-0.0494 ( 4490 PWs) bands (ev): -37.3468 -37.3468 -11.9172 -11.9172 -10.6921 -10.6921 0.0792 0.0792 0.7663 0.7663 1.5449 1.5449 1.7304 1.7304 3.7024 3.7024 3.8856 3.8856 4.5209 4.5209 4.7375 4.7375 5.0102 5.0102 5.6090 5.6090 7.8039 7.8039 13.8472 13.8472 15.2693 15.2693 18.1573 18.1573 k = 0.5000 0.2370-0.0395 ( 4490 PWs) bands (ev): -37.3468 -37.3468 -11.9206 -11.9206 -10.6875 -10.6875 0.0748 0.0748 0.7652 0.7652 1.5463 1.5463 1.7264 1.7264 3.7021 3.7021 3.8855 3.8855 4.5260 4.5260 4.7642 4.7642 5.0121 5.0121 5.5845 5.5845 7.7986 7.7986 13.8641 13.8641 15.2433 15.2433 18.1590 18.1590 k = 0.5000 0.2370-0.0296 ( 4498 PWs) bands (ev): -37.3468 -37.3468 -11.9232 -11.9232 -10.6839 -10.6839 0.0714 0.0714 0.7643 0.7643 1.5474 1.5474 1.7232 1.7232 3.7019 3.7019 3.8855 3.8855 4.5300 4.5300 4.7866 4.7866 5.0134 5.0134 5.5641 5.5641 7.7944 7.7944 13.8780 13.8780 15.2225 15.2225 18.1603 18.1603 k = 0.5000 0.2370-0.0196 ( 4496 PWs) bands (ev): -37.3468 -37.3468 -11.9251 -11.9251 -10.6813 -10.6813 0.0689 0.0689 0.7637 0.7637 1.5482 1.5482 1.7209 1.7209 3.7017 3.7017 3.8855 3.8855 4.5329 4.5329 4.8036 4.8036 5.0142 5.0142 5.5485 5.5485 7.7913 7.7913 13.8883 13.8883 15.2072 15.2072 18.1613 18.1613 k = 0.5000 0.2370-0.0097 ( 4494 PWs) bands (ev): -37.3468 -37.3468 -11.9263 -11.9263 -10.6797 -10.6797 0.0674 0.0674 0.7633 0.7633 1.5487 1.5487 1.7195 1.7195 3.7016 3.7016 3.8855 3.8855 4.5347 4.5347 4.8143 4.8143 5.0147 5.0147 5.5388 5.5388 7.7895 7.7895 13.8946 13.8946 15.1979 15.1979 18.1619 18.1619 k = 0.5000 0.2370 0.0002 ( 4498 PWs) bands (ev): -37.3468 -37.3468 -11.9267 -11.9267 -10.6792 -10.6792 0.0669 0.0669 0.7631 0.7631 1.5489 1.5489 1.7190 1.7190 3.7016 3.7016 3.8855 3.8855 4.5352 4.5352 4.8180 4.8180 5.0148 5.0148 5.5355 5.5355 7.7889 7.7889 13.8967 13.8967 15.1948 15.1948 18.1621 18.1621 k = 0.5000 0.2370 0.0002 ( 4498 PWs) bands (ev): -37.3468 -37.3468 -11.9267 -11.9267 -10.6792 -10.6792 0.0669 0.0669 0.7631 0.7631 1.5489 1.5489 1.7190 1.7190 3.7016 3.7016 3.8855 3.8855 4.5352 4.5352 4.8180 4.8180 5.0148 5.0148 5.5355 5.5355 7.7889 7.7889 13.8967 13.8967 15.1948 15.1948 18.1621 18.1621 k = 0.5043 0.2280 0.0002 ( 4498 PWs) bands (ev): -37.3468 -37.3468 -11.9261 -11.9261 -10.6792 -10.6792 0.0679 0.0679 0.7631 0.7631 1.5496 1.5496 1.7191 1.7191 3.6984 3.6984 3.8860 3.8860 4.5352 4.5352 4.8176 4.8176 5.0145 5.0145 5.5356 5.5356 7.7873 7.7873 13.8973 13.8973 15.1977 15.1977 18.1613 18.1613 k = 0.5085 0.2190 0.0002 ( 4498 PWs) bands (ev): -37.3467 -37.3467 -11.9243 -11.9243 -10.6792 -10.6792 0.0711 0.0711 0.7629 0.7629 1.5520 1.5520 1.7194 1.7194 3.6889 3.6889 3.8876 3.8876 4.5349 4.5349 4.8165 4.8165 5.0137 5.0137 5.5361 5.5361 7.7824 7.7824 13.8990 13.8990 15.2063 15.2063 18.1592 18.1592 k = 0.5128 0.2100 0.0002 ( 4498 PWs) bands (ev): -37.3467 -37.3467 -11.9213 -11.9213 -10.6793 -10.6793 0.0764 0.0764 0.7625 0.7625 1.5558 1.5558 1.7198 1.7198 3.6731 3.6731 3.8902 3.8902 4.5344 4.5344 4.8145 4.8145 5.0122 5.0122 5.5368 5.5368 7.7745 7.7745 13.9019 13.9019 15.2205 15.2205 18.1555 18.1555 k = 0.5171 0.2010 0.0002 ( 4508 PWs) bands (ev): -37.3466 -37.3466 -11.9172 -11.9172 -10.6793 -10.6793 0.0838 0.0838 0.7621 0.7621 1.5613 1.5613 1.7204 1.7204 3.6510 3.6510 3.8939 3.8939 4.5337 4.5337 4.8118 4.8118 5.0102 5.0102 5.5377 5.5377 7.7636 7.7636 13.9059 13.9059 15.2403 15.2403 18.1504 18.1504 k = 0.5214 0.1920 0.0002 ( 4508 PWs) bands (ev): -37.3464 -37.3464 -11.9118 -11.9118 -10.6793 -10.6793 0.0933 0.0933 0.7616 0.7616 1.5683 1.5683 1.7212 1.7212 3.6228 3.6228 3.8986 3.8986 4.5329 4.5329 4.8082 4.8082 5.0076 5.0076 5.5388 5.5388 7.7498 7.7498 13.9110 13.9110 15.2656 15.2656 18.1437 18.1437 k = 0.5256 0.1829 0.0002 ( 4504 PWs) bands (ev): -37.3463 -37.3463 -11.9053 -11.9053 -10.6794 -10.6794 0.1049 0.1049 0.7610 0.7610 1.5768 1.5768 1.7222 1.7222 3.5887 3.5887 3.9045 3.9045 4.5318 4.5318 4.8036 4.8036 5.0043 5.0043 5.5399 5.5399 7.7334 7.7334 13.9171 13.9171 15.2961 15.2961 18.1355 18.1355 k = 0.5299 0.1739 0.0002 ( 4502 PWs) bands (ev): -37.3461 -37.3461 -11.8977 -11.8977 -10.6795 -10.6795 0.1185 0.1185 0.7605 0.7605 1.5868 1.5868 1.7233 1.7233 3.5488 3.5488 3.9114 3.9114 4.5306 4.5306 4.7980 4.7980 5.0005 5.0005 5.5412 5.5412 7.7147 7.7147 13.9244 13.9244 15.3317 15.3317 18.1257 18.1257 k = 0.5342 0.1649 0.0002 ( 4506 PWs) bands (ev): -37.3459 -37.3459 -11.8889 -11.8889 -10.6795 -10.6795 0.1342 0.1342 0.7600 0.7600 1.5983 1.5983 1.7245 1.7245 3.5035 3.5035 3.9192 3.9192 4.5292 4.5292 4.7912 4.7912 4.9960 4.9960 5.5423 5.5423 7.6939 7.6939 13.9326 13.9326 15.3722 15.3722 18.1143 18.1143 k = 0.5384 0.1559 0.0002 ( 4522 PWs) bands (ev): -37.3456 -37.3456 -11.8790 -11.8790 -10.6797 -10.6797 0.1519 0.1519 0.7596 0.7596 1.6114 1.6114 1.7258 1.7258 3.4531 3.4531 3.9280 3.9280 4.5276 4.5276 4.7833 4.7833 4.9910 4.9910 5.5434 5.5434 7.6714 7.6714 13.9418 13.9418 15.4174 15.4174 18.1012 18.1012 k = 0.5427 0.1469 0.0002 ( 4518 PWs) bands (ev): -37.3453 -37.3453 -11.8680 -11.8680 -10.6798 -10.6798 0.1716 0.1716 0.7593 0.7593 1.6259 1.6259 1.7273 1.7273 3.3978 3.3978 3.9375 3.9375 4.5258 4.5258 4.7740 4.7740 4.9853 4.9853 5.5443 5.5443 7.6476 7.6476 13.9519 13.9519 15.4669 15.4669 18.0865 18.0865 k = 0.5470 0.1379 0.0002 ( 4510 PWs) bands (ev): -37.3450 -37.3450 -11.8560 -11.8560 -10.6800 -10.6800 0.1932 0.1932 0.7593 0.7593 1.6418 1.6418 1.7289 1.7289 3.3380 3.3380 3.9475 3.9475 4.5238 4.5238 4.7635 4.7635 4.9789 4.9789 5.5449 5.5449 7.6227 7.6227 13.9630 13.9630 15.5204 15.5204 18.0701 18.0701 k = 0.5513 0.1289 0.0002 ( 4512 PWs) bands (ev): -37.3447 -37.3447 -11.8429 -11.8429 -10.6802 -10.6802 0.2168 0.2168 0.7596 0.7596 1.6591 1.6591 1.7308 1.7308 3.2740 3.2740 3.9580 3.9580 4.5215 4.5215 4.7517 4.7517 4.9719 4.9719 5.5453 5.5453 7.5972 7.5972 13.9749 13.9749 15.5778 15.5778 18.0522 18.0522 k = 0.5555 0.1199 0.0002 ( 4502 PWs) bands (ev): -37.3444 -37.3444 -11.8287 -11.8287 -10.6804 -10.6804 0.2422 0.2422 0.7603 0.7603 1.6775 1.6775 1.7329 1.7329 3.2063 3.2063 3.9686 3.9686 4.5190 4.5190 4.7385 4.7385 4.9642 4.9642 5.5453 5.5453 7.5714 7.5714 13.9876 13.9876 15.6386 15.6386 18.0326 18.0326 k = 0.5598 0.1109 0.0002 ( 4510 PWs) bands (ev): -37.3440 -37.3440 -11.8136 -11.8136 -10.6807 -10.6807 0.2694 0.2694 0.7614 0.7614 1.6968 1.6968 1.7358 1.7358 3.1350 3.1350 3.9791 3.9791 4.5162 4.5162 4.7242 4.7242 4.9559 4.9559 5.5449 5.5449 7.5458 7.5458 14.0010 14.0010 15.7026 15.7026 18.0116 18.0116 k = 0.5641 0.1019 0.0002 ( 4506 PWs) bands (ev): -37.3436 -37.3436 -11.7976 -11.7976 -10.6810 -10.6810 0.2984 0.2984 0.7630 0.7630 1.7152 1.7152 1.7411 1.7411 3.0606 3.0606 3.9889 3.9889 4.5130 4.5130 4.7090 4.7090 4.9468 4.9468 5.5441 5.5441 7.5206 7.5206 14.0152 14.0152 15.7694 15.7694 17.9890 17.9890 k = 0.5683 0.0928 0.0002 ( 4502 PWs) bands (ev): -37.3432 -37.3432 -11.7806 -11.7806 -10.6814 -10.6814 0.3291 0.3291 0.7652 0.7652 1.7277 1.7277 1.7537 1.7537 2.9835 2.9835 3.9977 3.9977 4.5095 4.5095 4.6931 4.6931 4.9371 4.9371 5.5429 5.5429 7.4962 7.4962 14.0300 14.0300 15.8387 15.8387 17.9651 17.9651 k = 0.5726 0.0838 0.0002 ( 4504 PWs) bands (ev): -37.3428 -37.3428 -11.7627 -11.7627 -10.6818 -10.6818 0.3613 0.3613 0.7680 0.7680 1.7333 1.7333 1.7746 1.7746 2.9041 2.9041 4.0047 4.0047 4.5056 4.5056 4.6771 4.6771 4.9267 4.9267 5.5412 5.5412 7.4730 7.4730 14.0454 14.0454 15.9101 15.9101 17.9399 17.9399 k = 0.5769 0.0748 0.0002 ( 4502 PWs) bands (ev): -37.3423 -37.3423 -11.7440 -11.7440 -10.6823 -10.6823 0.3951 0.3951 0.7716 0.7716 1.7365 1.7365 1.7994 1.7994 2.8226 2.8226 4.0093 4.0093 4.5013 4.5013 4.6616 4.6616 4.9156 4.9156 5.5390 5.5390 7.4511 7.4511 14.0615 14.0615 15.9834 15.9834 17.9135 17.9135 k = 0.5812 0.0658 0.0002 ( 4506 PWs) bands (ev): -37.3419 -37.3419 -11.7245 -11.7245 -10.6829 -10.6829 0.4302 0.4302 0.7760 0.7760 1.7390 1.7390 1.8262 1.8262 2.7395 2.7395 4.0103 4.0103 4.4966 4.4966 4.6473 4.6473 4.9039 4.9039 5.5364 5.5364 7.4309 7.4309 14.0780 14.0780 16.0583 16.0583 17.8860 17.8860 k = 0.5854 0.0568 0.0002 ( 4508 PWs) bands (ev): -37.3414 -37.3414 -11.7043 -11.7043 -10.6835 -10.6835 0.4665 0.4665 0.7813 0.7813 1.7413 1.7413 1.8546 1.8546 2.6552 2.6552 4.0070 4.0070 4.4915 4.4915 4.6349 4.6349 4.8916 4.8916 5.5332 5.5332 7.4124 7.4124 14.0951 14.0951 16.1343 16.1343 17.8575 17.8575 k = 0.5897 0.0478 0.0002 ( 4508 PWs) bands (ev): -37.3409 -37.3409 -11.6834 -11.6834 -10.6843 -10.6843 0.5039 0.5039 0.7876 0.7876 1.7436 1.7436 1.8844 1.8844 2.5702 2.5702 3.9981 3.9981 4.4862 4.4862 4.6255 4.6255 4.8787 4.8787 5.5296 5.5296 7.3959 7.3959 14.1126 14.1126 16.2112 16.2112 17.8281 17.8281 k = 0.5940 0.0388 0.0002 ( 4506 PWs) bands (ev): -37.3404 -37.3404 -11.6618 -11.6618 -10.6851 -10.6851 0.5421 0.5421 0.7949 0.7949 1.7460 1.7460 1.9154 1.9154 2.4848 2.4848 3.9829 3.9829 4.4807 4.4807 4.6195 4.6195 4.8653 4.8653 5.5255 5.5255 7.3814 7.3814 14.1305 14.1305 16.2887 16.2887 17.7981 17.7981 k = 0.5982 0.0298 0.0002 ( 4514 PWs) bands (ev): -37.3399 -37.3399 -11.6396 -11.6396 -10.6860 -10.6860 0.5808 0.5808 0.8035 0.8035 1.7485 1.7485 1.9475 1.9475 2.3998 2.3998 3.9608 3.9608 4.4750 4.4750 4.6174 4.6174 4.8515 4.8515 5.5210 5.5210 7.3690 7.3690 14.1488 14.1488 16.3666 16.3666 17.7675 17.7675 k = 0.6025 0.0208 0.0002 ( 4506 PWs) bands (ev): -37.3394 -37.3394 -11.6169 -11.6169 -10.6870 -10.6870 0.6197 0.6197 0.8134 0.8134 1.7511 1.7511 1.9805 1.9805 2.3156 2.3156 3.9313 3.9313 4.4691 4.4691 4.6195 4.6195 4.8377 4.8377 5.5160 5.5160 7.3586 7.3586 14.1674 14.1674 16.4445 16.4445 17.7364 17.7364 k = 0.6068 0.0117 0.0002 ( 4504 PWs) bands (ev): -37.3388 -37.3388 -11.5937 -11.5937 -10.6882 -10.6882 0.6582 0.6582 0.8249 0.8249 1.7538 1.7538 2.0137 2.0137 2.2337 2.2337 3.8948 3.8948 4.4629 4.4629 4.6252 4.6252 4.8242 4.8242 5.5105 5.5105 7.3503 7.3503 14.1863 14.1863 16.5223 16.5223 17.7051 17.7051 k = 0.6111 0.0027 0.0002 ( 4500 PWs) bands (ev): -37.3383 -37.3383 -11.5701 -11.5701 -10.6894 -10.6894 0.6958 0.6958 0.8380 0.8380 1.7568 1.7568 2.0440 2.0440 2.1578 2.1578 3.8515 3.8515 4.4562 4.4562 4.6337 4.6337 4.8117 4.8117 5.5047 5.5047 7.3438 7.3438 14.2054 14.2054 16.5996 16.5996 17.6736 17.6736 k = 0.6153-0.0063 0.0002 ( 4498 PWs) bands (ev): -37.3378 -37.3378 -11.5461 -11.5461 -10.6908 -10.6908 0.7316 0.7316 0.8530 0.8530 1.7599 1.7599 2.0433 2.0433 2.1166 2.1166 3.8022 3.8022 4.4488 4.4488 4.6434 4.6434 4.8015 4.8015 5.4984 5.4984 7.3392 7.3392 14.2248 14.2248 16.6764 16.6764 17.6422 17.6422 k = 0.6196-0.0153 0.0002 ( 4502 PWs) bands (ev): -37.3372 -37.3372 -11.5219 -11.5219 -10.6923 -10.6923 0.7647 0.7647 0.8700 0.8700 1.7631 1.7631 1.9838 1.9838 2.1393 2.1393 3.7474 3.7474 4.4407 4.4407 4.6517 4.6517 4.7957 4.7957 5.4918 5.4918 7.3363 7.3363 14.2443 14.2443 16.7523 16.7523 17.6109 17.6109 k = 0.6239-0.0243 0.0002 ( 4502 PWs) bands (ev): -37.3367 -37.3367 -11.4974 -11.4974 -10.6939 -10.6939 0.7944 0.7944 0.8888 0.8888 1.7663 1.7663 1.9172 1.9172 2.1755 2.1755 3.6879 3.6879 4.4316 4.4316 4.6552 4.6552 4.7972 4.7972 5.4849 5.4849 7.3348 7.3348 14.2640 14.2640 16.8273 16.8273 17.5800 17.5800 k = 0.6281-0.0333 0.0002 ( 4498 PWs) bands (ev): -37.3361 -37.3361 -11.4728 -11.4728 -10.6957 -10.6957 0.8200 0.8200 0.9084 0.9084 1.7686 1.7686 1.8565 1.8565 2.2147 2.2147 3.6243 3.6243 4.4217 4.4217 4.6519 4.6519 4.8076 4.8076 5.4776 5.4776 7.3347 7.3347 14.2839 14.2839 16.9012 16.9012 17.5496 17.5496 k = 0.6324-0.0423 0.0002 ( 4486 PWs) bands (ev): -37.3356 -37.3356 -11.4482 -11.4482 -10.6976 -10.6976 0.8414 0.8414 0.9273 0.9273 1.7650 1.7650 1.8101 1.8101 2.2555 2.2555 3.5572 3.5572 4.4108 4.4108 4.6418 4.6418 4.8265 4.8265 5.4700 5.4700 7.3358 7.3358 14.3038 14.3038 16.9739 16.9739 17.5198 17.5198 k = 0.6367-0.0513 0.0002 ( 4482 PWs) bands (ev): -37.3351 -37.3351 -11.4235 -11.4235 -10.6997 -10.6997 0.8578 0.8578 0.9441 0.9441 1.7416 1.7416 1.7945 1.7945 2.2974 2.2974 3.4872 3.4872 4.3988 4.3988 4.6268 4.6268 4.8517 4.8517 5.4622 5.4622 7.3377 7.3377 14.3239 14.3239 17.0452 17.0452 17.4908 17.4908 k = 0.6410-0.0603 0.0002 ( 4484 PWs) bands (ev): -37.3346 -37.3346 -11.3989 -11.3989 -10.7019 -10.7019 0.8675 0.8675 0.9586 0.9586 1.7142 1.7142 1.7962 1.7962 2.3403 2.3403 3.4146 3.4146 4.3857 4.3857 4.6085 4.6085 4.8813 4.8813 5.4542 5.4542 7.3404 7.3404 14.3440 14.3440 17.1150 17.1150 17.4628 17.4628 k = 0.6452-0.0694 0.0002 ( 4484 PWs) bands (ev): -37.3341 -37.3341 -11.3745 -11.3745 -10.7043 -10.7043 0.8668 0.8668 0.9729 0.9729 1.6980 1.6980 1.8018 1.8018 2.3841 2.3841 3.3401 3.3401 4.3714 4.3714 4.5880 4.5880 4.9139 4.9139 5.4460 5.4460 7.3437 7.3437 14.3641 14.3641 17.1830 17.1830 17.4358 17.4358 k = 0.6495-0.0784 0.0002 ( 4482 PWs) bands (ev): -37.3336 -37.3336 -11.3504 -11.3504 -10.7069 -10.7069 0.8532 0.8532 0.9894 0.9894 1.6957 1.6957 1.8090 1.8090 2.4287 2.4287 3.2638 3.2638 4.3557 4.3557 4.5661 4.5661 4.9488 4.9488 5.4376 5.4376 7.3472 7.3472 14.3844 14.3844 17.2482 17.2482 17.4098 17.4098 k = 0.6538-0.0874 0.0002 ( 4484 PWs) bands (ev): -37.3331 -37.3331 -11.3266 -11.3266 -10.7096 -10.7096 0.8268 0.8268 1.0089 1.0089 1.7064 1.7064 1.8177 1.8177 2.4740 2.4740 3.1863 3.1863 4.3385 4.3385 4.5432 4.5432 4.9853 4.9853 5.4292 5.4292 7.3510 7.3510 14.4046 14.4046 17.2962 17.2962 17.3600 17.3600 k = 0.6580-0.0964 0.0002 ( 4484 PWs) bands (ev): -37.3326 -37.3326 -11.3032 -11.3032 -10.7125 -10.7125 0.7900 0.7900 1.0312 1.0312 1.7282 1.7282 1.8280 1.8280 2.5199 2.5199 3.1078 3.1078 4.3197 4.3197 4.5198 4.5198 5.0230 5.0230 5.4207 5.4207 7.3546 7.3546 14.4250 14.4250 17.2222 17.2222 17.3626 17.3626 k = 0.6623-0.1054 0.0002 ( 4484 PWs) bands (ev): -37.3322 -37.3322 -11.2803 -11.2803 -10.7156 -10.7156 0.7457 0.7457 1.0557 1.0557 1.7579 1.7579 1.8407 1.8407 2.5663 2.5663 3.0288 3.0288 4.2992 4.2992 4.4960 4.4960 5.0616 5.0616 5.4123 5.4123 7.3580 7.3580 14.4453 14.4453 17.1157 17.1157 17.3417 17.3417 k = 0.6666-0.1144 0.0002 ( 4488 PWs) bands (ev): -37.3317 -37.3317 -11.2579 -11.2579 -10.7189 -10.7189 0.6965 0.6965 1.0819 1.0819 1.7913 1.7913 1.8582 1.8582 2.6131 2.6131 2.9495 2.9495 4.2769 4.2769 4.4721 4.4721 5.1008 5.1008 5.4040 5.4040 7.3610 7.3610 14.4658 14.4658 17.0079 17.0079 17.3222 17.3222 k = 0.6709-0.1234 0.0002 ( 4496 PWs) bands (ev): -37.3313 -37.3313 -11.2363 -11.2363 -10.7224 -10.7224 0.6443 0.6443 1.1097 1.1097 1.8221 1.8221 1.8849 1.8849 2.6599 2.6599 2.8704 2.8704 4.2525 4.2525 4.4484 4.4484 5.1402 5.1402 5.3960 5.3960 7.3634 7.3634 14.4864 14.4864 16.9006 16.9006 17.3045 17.3045 k = 0.6751-0.1324 0.0002 ( 4492 PWs) bands (ev): -37.3309 -37.3309 -11.2154 -11.2154 -10.7261 -10.7261 0.5908 0.5908 1.1387 1.1387 1.8454 1.8454 1.9243 1.9243 2.7055 2.7055 2.7932 2.7932 4.2262 4.2262 4.4249 4.4249 5.1795 5.1795 5.3884 5.3884 7.3651 7.3651 14.5070 14.5070 16.7943 16.7943 17.2887 17.2887 k = 0.6794-0.1414 0.0002 ( 4484 PWs) bands (ev): -37.3305 -37.3305 -11.1953 -11.1953 -10.7299 -10.7299 0.5371 0.5371 1.1688 1.1688 1.8638 1.8638 1.9728 1.9728 2.7046 2.7046 2.7633 2.7633 4.1978 4.1978 4.4018 4.4018 5.2182 5.2182 5.3818 5.3818 7.3659 7.3659 14.5279 14.5279 16.6893 16.6893 17.2748 17.2748 k = 0.6837-0.1505 0.0002 ( 4486 PWs) bands (ev): -37.3302 -37.3302 -11.1762 -11.1762 -10.7340 -10.7340 0.4842 0.4842 1.2000 1.2000 1.8804 1.8804 2.0263 2.0263 2.6308 2.6308 2.8073 2.8073 4.1675 4.1675 4.3791 4.3791 5.2552 5.2552 5.3770 5.3770 7.3657 7.3657 14.5489 14.5489 16.5859 16.5859 17.2629 17.2629 k = 0.6879-0.1595 0.0002 ( 4480 PWs) bands (ev): -37.3298 -37.3298 -11.1580 -11.1580 -10.7383 -10.7383 0.4327 0.4327 1.2320 1.2320 1.8965 1.8965 2.0827 2.0827 2.5549 2.5549 2.8547 2.8547 4.1353 4.1353 4.3569 4.3569 5.2880 5.2880 5.3765 5.3765 7.3643 7.3643 14.5701 14.5701 16.4842 16.4842 17.2531 17.2531 k = 0.6922-0.1685 0.0002 ( 4480 PWs) bands (ev): -37.3295 -37.3295 -11.1410 -11.1410 -10.7427 -10.7427 0.3831 0.3831 1.2647 1.2647 1.9125 1.9125 2.1408 2.1408 2.4806 2.4806 2.9026 2.9026 4.1014 4.1014 4.3351 4.3351 5.3107 5.3107 5.3861 5.3861 7.3617 7.3617 14.5916 14.5916 16.3844 16.3844 17.2455 17.2455 k = 0.6965-0.1775 0.0002 ( 4476 PWs) bands (ev): -37.3293 -37.3293 -11.1251 -11.1251 -10.7474 -10.7474 0.3360 0.3360 1.2980 1.2980 1.9279 1.9279 2.1998 2.1998 2.4089 2.4089 2.9504 2.9504 4.0660 4.0660 4.3138 4.3138 5.3191 5.3191 5.4098 5.4098 7.3577 7.3577 14.6134 14.6134 16.2865 16.2865 17.2400 17.2400 k = 0.7008-0.1865 0.0002 ( 4476 PWs) bands (ev): -37.3290 -37.3290 -11.1104 -11.1104 -10.7523 -10.7523 0.2917 0.2917 1.3317 1.3317 1.9417 1.9417 2.2590 2.2590 2.3417 2.3417 2.9980 2.9980 4.0293 4.0293 4.2929 4.2929 5.3187 5.3187 5.4422 5.4422 7.3522 7.3522 14.6356 14.6356 16.1908 16.1908 17.2367 17.2367 k = 0.7050-0.1955 0.0002 ( 4472 PWs) bands (ev): -37.3288 -37.3288 -11.0970 -11.0970 -10.7573 -10.7573 0.2503 0.2503 1.3656 1.3656 1.9515 1.9515 2.2805 2.2805 2.3192 2.3192 3.0453 3.0453 3.9916 3.9916 4.2725 4.2725 5.3151 5.3151 5.4777 5.4777 7.3453 7.3453 14.6581 14.6581 16.0971 16.0971 17.2356 17.2356 k = 0.7093-0.2045 0.0002 ( 4472 PWs) bands (ev): -37.3286 -37.3286 -11.0850 -11.0850 -10.7626 -10.7626 0.2123 0.2123 1.3996 1.3996 1.9525 1.9525 2.2329 2.2329 2.3772 2.3772 3.0919 3.0919 3.9530 3.9530 4.2526 4.2526 5.3103 5.3103 5.5140 5.5140 7.3367 7.3367 14.6811 14.6811 16.0057 16.0057 17.2366 17.2366 k = 0.7136-0.2135 0.0002 ( 4462 PWs) bands (ev): -37.3284 -37.3284 -11.0744 -11.0744 -10.7681 -10.7681 0.1778 0.1778 1.4334 1.4334 1.9385 1.9385 2.2037 2.2037 2.4345 2.4345 3.1379 3.1379 3.9141 3.9141 4.2334 4.2334 5.3054 5.3054 5.5501 5.5501 7.3266 7.3266 14.7046 14.7046 15.9164 15.9164 17.2399 17.2399 k = 0.2864-0.6043 0.3280 ( 4462 PWs) bands (ev): -37.3284 -37.3284 -11.0744 -11.0744 -10.7681 -10.7681 0.1778 0.1778 1.4334 1.4334 1.9385 1.9385 2.2037 2.2037 2.4345 2.4345 3.1379 3.1379 3.9141 3.9141 4.2334 4.2334 5.3054 5.3054 5.5501 5.5501 7.3266 7.3266 14.7046 14.7046 15.9164 15.9164 17.2399 17.2399 k = 0.2822-0.5952 0.3280 ( 4466 PWs) bands (ev): -37.3283 -37.3283 -11.0653 -11.0653 -10.7738 -10.7738 0.1470 0.1470 1.4669 1.4669 1.9064 1.9064 2.1966 2.1966 2.4900 2.4900 3.1830 3.1830 3.8749 3.8749 4.2149 4.2149 5.3006 5.3006 5.5858 5.5858 7.3148 7.3148 14.7287 14.7287 15.8293 15.8293 17.2453 17.2453 k = 0.2779-0.5862 0.3280 ( 4470 PWs) bands (ev): -37.3282 -37.3282 -11.0577 -11.0577 -10.7797 -10.7797 0.1199 0.1199 1.4995 1.4995 1.8604 1.8604 2.2079 2.2079 2.5432 2.5432 3.2270 3.2270 3.8361 3.8361 4.1974 4.1974 5.2962 5.2962 5.6205 5.6205 7.3013 7.3013 14.7533 14.7533 15.7444 15.7444 17.2529 17.2529 k = 0.2736-0.5772 0.3280 ( 4472 PWs) bands (ev): -37.3282 -37.3282 -11.0517 -11.0517 -10.7858 -10.7858 0.0969 0.0969 1.5308 1.5308 1.8073 1.8073 2.2316 2.2316 2.5933 2.5933 3.2699 3.2699 3.7979 3.7979 4.1810 4.1810 5.2924 5.2924 5.6543 5.6543 7.2861 7.2861 14.7784 14.7784 15.6618 15.6618 17.2627 17.2627 k = 0.2693-0.5682 0.3280 ( 4468 PWs) bands (ev): -37.3281 -37.3281 -11.0473 -11.0473 -10.7921 -10.7921 0.0779 0.0779 1.5592 1.5592 1.7529 1.7529 2.2635 2.2635 2.6395 2.6395 3.3112 3.3112 3.7610 3.7610 4.1662 4.1662 5.2893 5.2893 5.6869 5.6869 7.2692 7.2692 14.8041 14.8041 15.5813 15.5813 17.2746 17.2746 k = 0.2651-0.5592 0.3280 ( 4468 PWs) bands (ev): -37.3281 -37.3281 -11.0446 -11.0446 -10.7986 -10.7986 0.0631 0.0631 1.5794 1.5794 1.7047 1.7047 2.3013 2.3013 2.6808 2.6808 3.3510 3.3510 3.7259 3.7259 4.1531 4.1531 5.2870 5.2870 5.7181 5.7181 7.2507 7.2507 14.8304 14.8304 15.5029 15.5029 17.2887 17.2887 k = 0.2608-0.5501 0.3280 ( 4474 PWs) bands (ev): -37.3282 -37.3282 -11.0435 -11.0435 -10.8053 -10.8053 0.0525 0.0525 1.5742 1.5742 1.6813 1.6813 2.3437 2.3437 2.7163 2.7163 3.3890 3.3890 3.6931 3.6931 4.1424 4.1424 5.2856 5.2856 5.7478 5.7478 7.2306 7.2306 14.8572 14.8572 15.4266 15.4266 17.3049 17.3049 k = 0.2565-0.5411 0.3280 ( 4482 PWs) bands (ev): -37.3283 -37.3283 -11.0442 -11.0442 -10.8122 -10.8122 0.0462 0.0462 1.5353 1.5353 1.6917 1.6917 2.3900 2.3900 2.7449 2.7449 3.4252 3.4252 3.6633 3.6633 4.1344 4.1344 5.2852 5.2852 5.7760 5.7760 7.2089 7.2089 14.8846 14.8846 15.3523 15.3523 17.3232 17.3232 k = 0.2522-0.5321 0.3280 ( 4496 PWs) bands (ev): -37.3284 -37.3284 -11.0465 -11.0465 -10.8193 -10.8193 0.0442 0.0442 1.4835 1.4835 1.7157 1.7157 2.4398 2.4398 2.7654 2.7654 3.4592 3.4592 3.6371 3.6371 4.1296 4.1296 5.2859 5.2859 5.8025 5.8025 7.1858 7.1858 14.9124 14.9124 15.2800 15.2800 17.3436 17.3436 k = 0.2480-0.5231 0.3280 ( 4500 PWs) bands (ev): -37.3285 -37.3285 -11.0505 -11.0505 -10.8265 -10.8265 0.0466 0.0466 1.4289 1.4289 1.7433 1.7433 2.4927 2.4927 2.7772 2.7772 3.4908 3.4908 3.6150 3.6150 4.1285 4.1285 5.2877 5.2877 5.8272 5.8272 7.1612 7.1612 14.9406 14.9406 15.2094 15.2094 17.3661 17.3661 k = 0.2437-0.5141 0.3280 ( 4494 PWs) bands (ev): -37.3287 -37.3287 -11.0562 -11.0562 -10.8339 -10.8339 0.0533 0.0533 1.3743 1.3743 1.7721 1.7721 2.5483 2.5483 2.7797 2.7797 3.5183 3.5183 3.5987 3.5987 4.1315 4.1315 5.2909 5.2909 5.8499 5.8499 7.1354 7.1354 14.9690 14.9690 15.1406 15.1406 17.3908 17.3908 k = 0.2394-0.5050 0.3280 ( 4492 PWs) bands (ev): -37.3289 -37.3289 -11.0636 -11.0636 -10.8415 -10.8415 0.0644 0.0644 1.3207 1.3207 1.8013 1.8013 2.6065 2.6065 2.7729 2.7729 3.5353 3.5353 3.5941 3.5941 4.1388 4.1388 5.2954 5.2954 5.8707 5.8707 7.1084 7.1084 14.9977 14.9977 15.0735 15.0735 17.4177 17.4177 k = 0.2351-0.4960 0.3280 ( 4492 PWs) bands (ev): -37.3292 -37.3292 -11.0726 -11.0726 -10.8493 -10.8493 0.0799 0.0799 1.2685 1.2685 1.8307 1.8307 2.6669 2.6669 2.7573 2.7573 3.5340 3.5340 3.6086 3.6086 4.1506 4.1506 5.3013 5.3013 5.8893 5.8893 7.0804 7.0804 15.0073 15.0073 15.0268 15.0268 17.4469 17.4469 k = 0.2309-0.4870 0.3280 ( 4488 PWs) bands (ev): -37.3294 -37.3294 -11.0833 -11.0833 -10.8572 -10.8572 0.0997 0.0997 1.2179 1.2179 1.8602 1.8602 2.7260 2.7260 2.7371 2.7371 3.5223 3.5223 3.6335 3.6335 4.1667 4.1667 5.3087 5.3087 5.9057 5.9057 7.0515 7.0515 14.9433 14.9433 15.0551 15.0551 17.4783 17.4783 k = 0.2266-0.4780 0.3280 ( 4482 PWs) bands (ev): -37.3297 -37.3297 -11.0956 -11.0956 -10.8652 -10.8652 0.1238 0.1238 1.1691 1.1691 1.8898 1.8898 2.7021 2.7021 2.7946 2.7946 3.5070 3.5070 3.6611 3.6611 4.1868 4.1868 5.3176 5.3176 5.9198 5.9198 7.0219 7.0219 14.8803 14.8803 15.0833 15.0833 17.5121 17.5121 k = 0.2223-0.4690 0.3280 ( 4478 PWs) bands (ev): -37.3301 -37.3301 -11.1094 -11.1094 -10.8734 -10.8734 0.1522 0.1522 1.1222 1.1222 1.9195 1.9195 2.6655 2.6655 2.8606 2.8606 3.4897 3.4897 3.6891 3.6891 4.2105 4.2105 5.3281 5.3281 5.9314 5.9314 6.9919 6.9919 14.8185 14.8185 15.1111 15.1111 17.5484 17.5484 k = 0.2180-0.4600 0.3280 ( 4480 PWs) bands (ev): -37.3305 -37.3305 -11.1247 -11.1247 -10.8818 -10.8818 0.1848 0.1848 1.0772 1.0772 1.9493 1.9493 2.6240 2.6240 2.9280 2.9280 3.4708 3.4708 3.7166 3.7166 4.2375 4.2375 5.3402 5.3402 5.9406 5.9406 6.9615 6.9615 14.7576 14.7576 15.1381 15.1381 17.5873 17.5873 k = 0.2138-0.4509 0.3280 ( 4484 PWs) bands (ev): -37.3309 -37.3309 -11.1414 -11.1414 -10.8902 -10.8902 0.2214 0.2214 1.0343 1.0343 1.9793 1.9793 2.5784 2.5784 2.9965 2.9965 3.4505 3.4505 3.7431 3.7431 4.2671 4.2671 5.3539 5.3539 5.9471 5.9471 6.9311 6.9311 14.6976 14.6976 15.1642 15.1642 17.6289 17.6289 k = 0.2095-0.4419 0.3280 ( 4486 PWs) bands (ev): -37.3313 -37.3313 -11.1596 -11.1596 -10.8988 -10.8988 0.2622 0.2622 0.9934 0.9934 2.0094 2.0094 2.5296 2.5296 3.0658 3.0658 3.4289 3.4289 3.7681 3.7681 4.2989 4.2989 5.3691 5.3691 5.9510 5.9510 6.9009 6.9009 14.6383 14.6383 15.1890 15.1890 17.6733 17.6733 k = 0.2052-0.4329 0.3280 ( 4486 PWs) bands (ev): -37.3318 -37.3318 -11.1790 -11.1790 -10.9075 -10.9075 0.3068 0.3068 0.9547 0.9547 2.0397 2.0397 2.4783 2.4783 3.1353 3.1353 3.4065 3.4065 3.7914 3.7914 4.3325 4.3325 5.3859 5.3859 5.9521 5.9521 6.8712 6.8712 14.5796 14.5796 15.2124 15.2124 17.7207 17.7207 k = 0.2009-0.4239 0.3280 ( 4492 PWs) bands (ev): -37.3323 -37.3323 -11.1997 -11.1997 -10.9163 -10.9163 0.3554 0.3554 0.9180 0.9180 2.0702 2.0702 2.4253 2.4253 3.2040 3.2040 3.3843 3.3843 3.8128 3.8128 4.3674 4.3674 5.4041 5.4041 5.9504 5.9504 6.8423 6.8423 14.5215 14.5215 15.2341 15.2341 17.7712 17.7712 k = 0.1967-0.4149 0.3280 ( 4492 PWs) bands (ev): -37.3328 -37.3328 -11.2216 -11.2216 -10.9252 -10.9252 0.4076 0.4076 0.8835 0.8835 2.1005 2.1005 2.3710 2.3710 3.2680 3.2680 3.3661 3.3661 3.8322 3.8322 4.4032 4.4032 5.4238 5.4238 5.9459 5.9459 6.8144 6.8144 14.4637 14.4637 15.2537 15.2537 17.8250 17.8250 k = 0.1924-0.4058 0.3280 ( 4490 PWs) bands (ev): -37.3333 -37.3333 -11.2446 -11.2446 -10.9342 -10.9342 0.4634 0.4634 0.8512 0.8512 2.1301 2.1301 2.3166 2.3166 3.3020 3.3020 3.3769 3.3769 3.8495 3.8495 4.4397 4.4397 5.4448 5.4448 5.9385 5.9385 6.7878 6.7878 14.4061 14.4061 15.2711 15.2711 17.8822 17.8822 k = 0.1881-0.3968 0.3280 ( 4482 PWs) bands (ev): -37.3339 -37.3339 -11.2686 -11.2686 -10.9432 -10.9432 0.5226 0.5226 0.8212 0.8212 2.1565 2.1565 2.2648 2.2648 3.2893 3.2893 3.4333 3.4333 3.8647 3.8647 4.4765 4.4765 5.4670 5.4670 5.9282 5.9282 6.7628 6.7628 14.3487 14.3487 15.2861 15.2861 17.9430 17.9430 k = 0.1838-0.3878 0.3280 ( 4476 PWs) bands (ev): -37.3345 -37.3345 -11.2935 -11.2935 -10.9523 -10.9523 0.5849 0.5849 0.7936 0.7936 2.1633 2.1633 2.2326 2.2326 3.2653 3.2653 3.4998 3.4998 3.8778 3.8778 4.5133 4.5133 5.4903 5.4903 5.9153 5.9153 6.7397 6.7397 14.2914 14.2914 15.2983 15.2983 18.0076 18.0076 k = 0.1796-0.3788 0.3280 ( 4472 PWs) bands (ev): -37.3351 -37.3351 -11.3193 -11.3193 -10.9614 -10.9614 0.6494 0.6494 0.7692 0.7692 2.1250 2.1250 2.2453 2.2453 3.2388 3.2388 3.5673 3.5673 3.8890 3.8890 4.5499 4.5499 5.5146 5.5146 5.8997 5.8997 6.7188 6.7188 14.2339 14.2339 15.3077 15.3077 18.0759 18.0759 k = 0.1753-0.3698 0.3280 ( 4474 PWs) bands (ev): -37.3357 -37.3357 -11.3458 -11.3458 -10.9706 -10.9706 0.7087 0.7087 0.7552 0.7552 2.0711 2.0711 2.2739 2.2739 3.2113 3.2113 3.6339 3.6339 3.8984 3.8984 4.5859 4.5859 5.5397 5.5397 5.8816 5.8816 6.7003 6.7003 14.1764 14.1764 15.3140 15.3140 18.1482 18.1482 k = 0.1710-0.3607 0.3280 ( 4482 PWs) bands (ev): -37.3364 -37.3364 -11.3731 -11.3731 -10.9798 -10.9798 0.7136 0.7136 0.8006 0.8006 2.0144 2.0144 2.3059 2.3059 3.1833 3.1833 3.6989 3.6989 3.9060 3.9060 4.6214 4.6214 5.5655 5.5655 5.8614 5.8614 6.6844 6.6844 14.1186 14.1186 15.3171 15.3171 18.2244 18.2244 k = 0.1667-0.3517 0.3280 ( 4478 PWs) bands (ev): -37.3371 -37.3371 -11.4009 -11.4009 -10.9890 -10.9890 0.6967 0.6967 0.8726 0.8726 1.9570 1.9570 2.3391 2.3391 3.1551 3.1551 3.7617 3.7617 3.9120 3.9120 4.6560 4.6560 5.5918 5.5918 5.8392 5.8392 6.6714 6.6714 14.0605 14.0605 15.3169 15.3169 18.3046 18.3046 k = 0.1625-0.3427 0.3280 ( 4472 PWs) bands (ev): -37.3377 -37.3377 -11.4292 -11.4292 -10.9982 -10.9982 0.6799 0.6799 0.9493 0.9493 1.8996 1.8996 2.3732 2.3732 3.1268 3.1268 3.8216 3.8216 3.9165 3.9165 4.6896 4.6896 5.6185 5.6185 5.8154 5.8154 6.6616 6.6616 14.0021 14.0021 15.3134 15.3134 18.3889 18.3889 k = 0.1582-0.3337 0.3280 ( 4478 PWs) bands (ev): -37.3384 -37.3384 -11.4580 -11.4580 -11.0073 -11.0073 0.6645 0.6645 1.0287 1.0287 1.8427 1.8427 2.4078 2.4078 3.0986 3.0986 3.8782 3.8782 3.9197 3.9197 4.7221 4.7221 5.6453 5.6453 5.7904 5.7904 6.6550 6.6550 13.9433 13.9433 15.3065 15.3065 18.4772 18.4772 k = 0.1539-0.3247 0.3280 ( 4476 PWs) bands (ev): -37.3391 -37.3391 -11.4870 -11.4870 -11.0165 -11.0165 0.6510 0.6510 1.1101 1.1101 1.7868 1.7868 2.4429 2.4429 3.0705 3.0705 3.9214 3.9214 3.9312 3.9312 4.7534 4.7534 5.6716 5.6716 5.7651 5.7651 6.6521 6.6521 13.8841 13.8841 15.2963 15.2963 18.5694 18.5694 k = 0.1496-0.3157 0.3280 ( 4476 PWs) bands (ev): -37.3399 -37.3399 -11.5164 -11.5164 -11.0256 -11.0256 0.6393 0.6393 1.1930 1.1930 1.7322 1.7322 2.4785 2.4785 3.0426 3.0426 3.9226 3.9226 3.9793 3.9793 4.7834 4.7834 5.6949 5.6949 5.7422 5.7422 6.6530 6.6530 13.8244 13.8244 15.2827 15.2827 18.6656 18.6656 k = 0.1454-0.3066 0.3280 ( 4474 PWs) bands (ev): -37.3406 -37.3406 -11.5459 -11.5459 -11.0346 -11.0346 0.6296 0.6296 1.2761 1.2761 1.6803 1.6803 2.5143 2.5143 3.0151 3.0151 3.9227 3.9227 4.0226 4.0226 4.8120 4.8120 5.6972 5.6972 5.7396 5.7396 6.6579 6.6579 13.7643 13.7643 15.2659 15.2659 18.7655 18.7655 k = 0.1411-0.2976 0.3280 ( 4486 PWs) bands (ev): -37.3413 -37.3413 -11.5754 -11.5754 -11.0436 -11.0436 0.6216 0.6216 1.3563 1.3563 1.6339 1.6339 2.5505 2.5505 2.9881 2.9881 3.9219 3.9219 4.0606 4.0606 4.8391 4.8391 5.6748 5.6748 5.7615 5.7615 6.6672 6.6672 13.7038 13.7038 15.2460 15.2460 18.8692 18.8692 k = 0.1368-0.2886 0.3280 ( 4490 PWs) bands (ev): -37.3421 -37.3421 -11.6050 -11.6050 -11.0525 -11.0525 0.6155 0.6155 1.4225 1.4225 1.6041 1.6041 2.5867 2.5867 2.9617 2.9617 3.9206 3.9206 4.0927 4.0927 4.8647 4.8647 5.6483 5.6483 5.7873 5.7873 6.6810 6.6810 13.6428 13.6428 15.2230 15.2230 18.9764 18.9764 k = 0.1325-0.2796 0.3280 ( 4490 PWs) bands (ev): -37.3428 -37.3428 -11.6345 -11.6345 -11.0613 -11.0613 0.6112 0.6112 1.4437 1.4437 1.6218 1.6218 2.6229 2.6229 2.9362 2.9362 3.9186 3.9186 4.1188 4.1188 4.8886 4.8886 5.6210 5.6210 5.8136 5.8136 6.6996 6.6996 13.5814 13.5814 15.1972 15.1972 19.0869 19.0869 k = 0.1283-0.2706 0.3280 ( 4494 PWs) bands (ev): -37.3436 -37.3436 -11.6638 -11.6638 -11.0700 -11.0700 0.6086 0.6086 1.4176 1.4176 1.6891 1.6891 2.6587 2.6587 2.9118 2.9118 3.9163 3.9163 4.1386 4.1386 4.9110 4.9110 5.5937 5.5937 5.8398 5.8398 6.7230 6.7230 13.5197 13.5197 15.1686 15.1686 19.2007 19.2007 k = 0.1240-0.2615 0.3280 ( 4488 PWs) bands (ev): -37.3443 -37.3443 -11.6929 -11.6929 -11.0786 -11.0786 0.6076 0.6076 1.3757 1.3757 1.7745 1.7745 2.6934 2.6934 2.8894 2.8894 3.9137 3.9137 4.1520 4.1520 4.9316 4.9316 5.5664 5.5664 5.8657 5.8657 6.7513 6.7513 13.4577 13.4577 15.1375 15.1375 19.3174 19.3174 k = 0.1197-0.2525 0.3280 ( 4488 PWs) bands (ev): -37.3450 -37.3450 -11.7216 -11.7216 -11.0870 -11.0870 0.6082 0.6082 1.3299 1.3299 1.8659 1.8659 2.7253 2.7253 2.8706 2.8706 3.9109 3.9109 4.1593 4.1593 4.9506 4.9506 5.5393 5.5393 5.8910 5.8910 6.7846 6.7846 13.3954 13.3954 15.1040 15.1040 19.4370 19.4370 k = 0.1154-0.2435 0.3280 ( 4490 PWs) bands (ev): -37.3458 -37.3458 -11.7500 -11.7500 -11.0953 -11.0953 0.6104 0.6104 1.2833 1.2833 1.9600 1.9600 2.7501 2.7501 2.8598 2.8598 3.9080 3.9080 4.1605 4.1605 4.9677 4.9677 5.5122 5.5122 5.9158 5.9158 6.8227 6.8227 13.3330 13.3330 15.0684 15.0684 19.5590 19.5590 k = 0.1112-0.2345 0.3280 ( 4492 PWs) bands (ev): -37.3465 -37.3465 -11.7780 -11.7780 -11.1034 -11.1034 0.6139 0.6139 1.2370 1.2370 2.0553 2.0553 2.7600 2.7600 2.8649 2.8649 3.9053 3.9053 4.1560 4.1560 4.9830 4.9830 5.4851 5.4851 5.9399 5.9399 6.8654 6.8654 13.2705 13.2705 15.0308 15.0308 19.6833 19.6833 k = 0.1069-0.2255 0.3280 ( 4498 PWs) bands (ev): -37.3472 -37.3472 -11.8054 -11.8054 -11.1113 -11.1113 0.6189 0.6189 1.1916 1.1916 2.1512 2.1512 2.7537 2.7537 2.8871 2.8871 3.9027 3.9027 4.1464 4.1464 4.9965 4.9965 5.4579 5.4579 5.9632 5.9632 6.9124 6.9124 13.2081 13.2081 14.9914 14.9914 19.8096 19.8096 k = 0.1026-0.2164 0.3280 ( 4492 PWs) bands (ev): -37.3479 -37.3479 -11.8322 -11.8322 -11.1191 -11.1191 0.6251 0.6251 1.1474 1.1474 2.2471 2.2471 2.7394 2.7394 2.9184 2.9184 3.9005 3.9005 4.1320 4.1320 5.0081 5.0081 5.4304 5.4304 5.9858 5.9858 6.9633 6.9633 13.1459 13.1459 14.9506 14.9506 19.9322 19.9327 k = 0.0983-0.2074 0.3280 ( 4500 PWs) bands (ev): -37.3486 -37.3486 -11.8585 -11.8585 -11.1266 -11.1266 0.6324 0.6324 1.1045 1.1045 2.3421 2.3421 2.7227 2.7227 2.9535 2.9535 3.8988 3.8988 4.1134 4.1134 5.0177 5.0177 5.4026 5.4026 6.0076 6.0076 7.0177 7.0177 13.0840 13.0840 14.9084 14.9084 19.9321 19.9321 k = 0.0941-0.1984 0.3280 ( 4496 PWs) bands (ev): -37.3493 -37.3493 -11.8840 -11.8840 -11.1340 -11.1340 0.6407 0.6407 1.0631 1.0631 2.4352 2.4352 2.7066 2.7066 2.9902 2.9902 3.8977 3.8977 4.0914 4.0914 5.0253 5.0253 5.3744 5.3744 6.0285 6.0285 7.0752 7.0752 13.0225 13.0225 14.8652 14.8652 19.9245 19.9245 k = 0.0898-0.1894 0.3280 ( 4492 PWs) bands (ev): -37.3500 -37.3500 -11.9087 -11.9087 -11.1410 -11.1410 0.6500 0.6500 1.0234 1.0234 2.5232 2.5232 2.6944 2.6944 3.0277 3.0277 3.8976 3.8976 4.0663 4.0663 5.0308 5.0308 5.3457 5.3457 6.0486 6.0486 7.1352 7.1352 12.9616 12.9616 14.8212 14.8212 19.9145 19.9145 k = 0.0855-0.1804 0.3280 ( 4490 PWs) bands (ev): -37.3506 -37.3506 -11.9327 -11.9327 -11.1479 -11.1479 0.6599 0.6599 0.9853 0.9853 2.5929 2.5929 2.6995 2.6995 3.0655 3.0655 3.8984 3.8984 4.0389 4.0389 5.0342 5.0342 5.3167 5.3167 6.0677 6.0677 7.1971 7.1971 12.9015 12.9015 14.7765 14.7765 19.9025 19.9025 k = 0.0812-0.1714 0.3280 ( 4492 PWs) bands (ev): -37.3512 -37.3512 -11.9558 -11.9558 -11.1545 -11.1545 0.6703 0.6703 0.9492 0.9492 2.6150 2.6150 2.7510 2.7510 3.1033 3.1033 3.9006 3.9006 4.0096 4.0096 5.0355 5.0355 5.2873 5.2873 6.0859 6.0859 7.2604 7.2604 12.8424 12.8424 14.7316 14.7316 19.8888 19.8888 k = 0.0770-0.1623 0.3280 ( 4492 PWs) bands (ev): -37.3518 -37.3518 -11.9780 -11.9780 -11.1608 -11.1608 0.6810 0.6810 0.9152 0.9152 2.6083 2.6083 2.8294 2.8294 3.1410 3.1410 3.9041 3.9041 3.9794 3.9794 5.0346 5.0346 5.2575 5.2575 6.1031 6.1031 7.3247 7.3247 12.7844 12.7844 14.6865 14.6865 19.8739 19.8739 k = 0.0727-0.1533 0.3280 ( 4492 PWs) bands (ev): -37.3524 -37.3524 -11.9992 -11.9992 -11.1669 -11.1669 0.6914 0.6914 0.8837 0.8837 2.5954 2.5954 2.9117 2.9117 3.1785 3.1785 3.9083 3.9083 3.9498 3.9498 5.0314 5.0314 5.2275 5.2275 6.1193 6.1193 7.3892 7.3892 12.7277 12.7277 14.6416 14.6416 19.8581 19.8581 k = 0.0684-0.1443 0.3280 ( 4494 PWs) bands (ev): -37.3530 -37.3530 -12.0195 -12.0195 -11.1727 -11.1727 0.7009 0.7009 0.8553 0.8553 2.5811 2.5811 2.9924 2.9924 3.2156 3.2156 3.9040 3.9040 3.9308 3.9308 5.0259 5.0259 5.1974 5.1974 6.1346 6.1346 7.4535 7.4535 12.6727 12.6727 14.5971 14.5971 19.8417 19.8417 k = 0.0641-0.1353 0.3280 ( 4500 PWs) bands (ev): -37.3535 -37.3535 -12.0387 -12.0387 -11.1781 -11.1781 0.7083 0.7083 0.8311 0.8311 2.5669 2.5669 3.0692 3.0692 3.2524 3.2524 3.8781 3.8781 3.9367 3.9367 5.0180 5.0180 5.1673 5.1673 6.1488 6.1488 7.5171 7.5171 12.6194 12.6194 14.5534 14.5534 19.8251 19.8251 k = 0.0599-0.1263 0.3280 ( 4506 PWs) bands (ev): -37.3540 -37.3540 -12.0569 -12.0569 -11.1833 -11.1833 0.7114 0.7114 0.8131 0.8131 2.5531 2.5531 3.1406 3.1406 3.2888 3.2888 3.8477 3.8477 3.9513 3.9513 5.0078 5.0078 5.1373 5.1373 6.1621 6.1621 7.5795 7.5795 12.5681 12.5681 14.5106 14.5106 19.8084 19.8084 k = 0.0556-0.1172 0.3280 ( 4512 PWs) bands (ev): -37.3545 -37.3545 -12.0739 -12.0739 -11.1882 -11.1882 0.7078 0.7078 0.8036 0.8036 2.5399 2.5399 3.2054 3.2054 3.3250 3.3250 3.8175 3.8175 3.9711 3.9711 4.9950 4.9950 5.1077 5.1077 6.1744 6.1744 7.6401 7.6401 12.5190 12.5190 14.4691 14.4691 19.7919 19.7919 k = 0.0513-0.1082 0.3280 ( 4514 PWs) bands (ev): -37.3549 -37.3549 -12.0898 -12.0898 -11.1927 -11.1927 0.6973 0.6973 0.8029 0.8029 2.5276 2.5276 3.2622 3.2622 3.3610 3.3610 3.7884 3.7884 3.9961 3.9961 4.9798 4.9798 5.0785 5.0785 6.1857 6.1857 7.6985 7.6985 12.4724 12.4724 14.4292 14.4292 19.7759 19.7759 k = 0.0470-0.0992 0.3280 ( 4508 PWs) bands (ev): -37.3553 -37.3553 -12.1046 -12.1046 -11.1969 -11.1969 0.6825 0.6825 0.8079 0.8079 2.5160 2.5160 3.3104 3.3104 3.3965 3.3965 3.7612 3.7612 4.0266 4.0266 4.9621 4.9621 5.0499 5.0499 6.1960 6.1960 7.7542 7.7542 12.4284 12.4284 14.3911 14.3911 19.7605 19.7605 k = 0.0428-0.0902 0.3280 ( 4504 PWs) bands (ev): -37.3557 -37.3557 -12.1182 -12.1182 -11.2008 -11.2008 0.6662 0.6662 0.8159 0.8159 2.5054 2.5054 3.3501 3.3501 3.4304 3.4304 3.7365 3.7365 4.0625 4.0625 4.9420 4.9420 5.0223 5.0223 6.2053 6.2053 7.8068 7.8068 12.3874 12.3874 14.3550 14.3550 19.7459 19.7459 k = 0.0385-0.0812 0.3280 ( 4506 PWs) bands (ev): -37.3561 -37.3561 -12.1305 -12.1305 -11.2043 -11.2043 0.6501 0.6501 0.8251 0.8251 2.4957 2.4957 3.3827 3.3827 3.4609 3.4609 3.7150 3.7150 4.1035 4.1035 4.9194 4.9194 4.9956 4.9956 6.2137 6.2137 7.8558 7.8558 12.3495 12.3495 14.3214 14.3214 19.7323 19.7323 k = 0.0342-0.0721 0.3280 ( 4512 PWs) bands (ev): -37.3564 -37.3564 -12.1416 -12.1416 -11.2074 -11.2074 0.6349 0.6349 0.8345 0.8345 2.4870 2.4870 3.4095 3.4095 3.4861 3.4861 3.6977 3.6977 4.1489 4.1489 4.8944 4.8944 4.9704 4.9704 6.2212 6.2212 7.9009 7.9009 12.3149 12.3149 14.2905 14.2905 19.7198 19.7198 k = 0.0299-0.0631 0.3280 ( 4520 PWs) bands (ev): -37.3567 -37.3567 -12.1515 -12.1515 -11.2102 -11.2102 0.6210 0.6210 0.8437 0.8437 2.4793 2.4793 3.4316 3.4316 3.5047 3.5047 3.6855 3.6855 4.1977 4.1977 4.8670 4.8670 4.9468 4.9468 6.2277 6.2277 7.9417 7.9417 12.2839 12.2839 14.2625 14.2625 19.7085 19.7085 k = 0.0257-0.0541 0.3280 ( 4530 PWs) bands (ev): -37.3569 -37.3569 -12.1600 -12.1600 -11.2127 -11.2127 0.6088 0.6088 0.8521 0.8521 2.4726 2.4726 3.4498 3.4498 3.5161 3.5161 3.6790 3.6790 4.2487 4.2487 4.8370 4.8370 4.9254 4.9254 6.2334 6.2334 7.9777 7.9777 12.2566 12.2566 14.2376 14.2376 19.6985 19.6985 k = 0.0214-0.0451 0.3280 ( 4522 PWs) bands (ev): -37.3571 -37.3571 -12.1673 -12.1673 -11.2147 -11.2147 0.5983 0.5983 0.8596 0.8596 2.4669 2.4669 3.4646 3.4646 3.5209 3.5209 3.6777 3.6777 4.3006 4.3006 4.8047 4.8047 4.9065 4.9065 6.2381 6.2381 8.0088 8.0088 12.2332 12.2332 14.2162 14.2162 19.6899 19.6899 k = 0.0171-0.0361 0.3280 ( 4522 PWs) bands (ev): -37.3573 -37.3573 -12.1733 -12.1733 -11.2164 -11.2164 0.5897 0.5897 0.8660 0.8660 2.4622 2.4622 3.4765 3.4765 3.5209 3.5209 3.6801 3.6801 4.3523 4.3523 4.7704 4.7704 4.8906 4.8906 6.2419 6.2419 8.0346 8.0346 12.2139 12.2139 14.1984 14.1984 19.6828 19.6828 k = 0.0128-0.0271 0.3280 ( 4530 PWs) bands (ev): -37.3574 -37.3574 -12.1779 -12.1779 -11.2178 -11.2178 0.5829 0.5829 0.8711 0.8711 2.4585 2.4585 3.4859 3.4859 3.5180 3.5180 3.6842 3.6842 4.4020 4.4020 4.7348 4.7348 4.8779 4.8779 6.2449 6.2449 8.0550 8.0550 12.1987 12.1987 14.1843 14.1843 19.6772 19.6772 k = 0.0086-0.0180 0.3280 ( 4530 PWs) bands (ev): -37.3575 -37.3575 -12.1813 -12.1813 -11.2187 -11.2187 0.5780 0.5780 0.8748 0.8748 2.4559 2.4559 3.4934 3.4934 3.5139 3.5139 3.6883 3.6883 4.4474 4.4474 4.7000 4.7000 4.8686 4.8686 6.2471 6.2471 8.0696 8.0696 12.1878 12.1878 14.1742 14.1742 19.6731 19.6731 k = 0.0043-0.0090 0.3280 ( 4528 PWs) bands (ev): -37.3576 -37.3576 -12.1833 -12.1833 -11.2193 -11.2193 0.5751 0.5751 0.8771 0.8771 2.4543 2.4543 3.4995 3.4995 3.5095 3.5095 3.6911 3.6911 4.4832 4.4832 4.6706 4.6706 4.8630 4.8630 6.2483 6.2483 8.0785 8.0785 12.1812 12.1812 14.1680 14.1680 19.6707 19.6707 k = 0.0000 0.0000 0.3280 ( 4534 PWs) bands (ev): -37.3576 -37.3576 -12.1839 -12.1839 -11.2195 -11.2195 0.5741 0.5741 0.8778 0.8778 2.4538 2.4538 3.5040 3.5040 3.5054 3.5054 3.6921 3.6921 4.4982 4.4982 4.6578 4.6578 4.8611 4.8611 6.2487 6.2487 8.0814 8.0814 12.1790 12.1790 14.1660 14.1660 19.6699 19.6699 k = 0.0000 0.0000 0.3280 ( 4534 PWs) bands (ev): -37.3576 -37.3576 -12.1839 -12.1839 -11.2195 -11.2195 0.5741 0.5741 0.8778 0.8778 2.4538 2.4538 3.5040 3.5040 3.5054 3.5054 3.6921 3.6921 4.4982 4.4982 4.6578 4.6578 4.8611 4.8611 6.2487 6.2487 8.0814 8.0814 12.1790 12.1790 14.1660 14.1660 19.6699 19.6699 k = 0.0091 0.0043 0.3280 ( 4528 PWs) bands (ev): -37.3576 -37.3576 -12.1836 -12.1836 -11.2193 -11.2193 0.5741 0.5741 0.8778 0.8778 2.4531 2.4531 3.4909 3.4909 3.5178 3.5178 3.6922 3.6922 4.4937 4.4937 4.6576 4.6576 4.8647 4.8647 6.2476 6.2476 8.0814 8.0814 12.1810 12.1810 14.1689 14.1689 19.6588 19.6588 k = 0.0182 0.0086 0.3280 ( 4530 PWs) bands (ev): -37.3576 -37.3576 -12.1825 -12.1825 -11.2186 -11.2186 0.5741 0.5741 0.8777 0.8777 2.4509 2.4509 3.4764 3.4764 3.5304 3.5304 3.6927 3.6927 4.4807 4.4807 4.6569 4.6569 4.8749 4.8749 6.2440 6.2440 8.0813 8.0813 12.1869 12.1869 14.1775 14.1775 19.6294 19.6294 k = 0.0273 0.0129 0.3280 ( 4530 PWs) bands (ev): -37.3575 -37.3575 -12.1807 -12.1807 -11.2176 -11.2176 0.5740 0.5740 0.8775 0.8775 2.4474 2.4474 3.4608 3.4608 3.5426 3.5426 3.6935 3.6935 4.4607 4.4607 4.6558 4.6558 4.8905 4.8905 6.2381 6.2381 8.0812 8.0812 12.1968 12.1968 14.1917 14.1917 19.5878 19.5878 k = 0.0364 0.0172 0.3280 ( 4526 PWs) bands (ev): -37.3575 -37.3575 -12.1782 -12.1782 -11.2162 -11.2162 0.5739 0.5739 0.8773 0.8773 2.4425 2.4425 3.4441 3.4441 3.5545 3.5545 3.6946 3.6946 4.4353 4.4353 4.6541 4.6541 4.9097 4.9097 6.2300 6.2300 8.0810 8.0810 12.2106 12.2106 14.2116 14.2116 19.5383 19.5383 k = 0.0454 0.0215 0.3280 ( 4526 PWs) bands (ev): -37.3574 -37.3574 -12.1750 -12.1750 -11.2143 -11.2143 0.5738 0.5738 0.8769 0.8769 2.4362 2.4362 3.4259 3.4259 3.5661 3.5661 3.6961 3.6961 4.4062 4.4062 4.6520 4.6520 4.9313 4.9313 6.2198 6.2198 8.0807 8.0807 12.2282 12.2282 14.2369 14.2369 19.4831 19.4831 k = 0.0545 0.0258 0.3280 ( 4526 PWs) bands (ev): -37.3573 -37.3573 -12.1712 -12.1712 -11.2121 -11.2121 0.5736 0.5736 0.8765 0.8765 2.4286 2.4286 3.4062 3.4062 3.5776 3.5776 3.6980 3.6980 4.3745 4.3745 4.6493 4.6493 4.9540 4.9540 6.2076 6.2076 8.0804 8.0804 12.2494 12.2494 14.2675 14.2675 19.4234 19.4234 k = 0.0636 0.0302 0.3280 ( 4520 PWs) bands (ev): -37.3572 -37.3572 -12.1666 -12.1666 -11.2094 -11.2094 0.5734 0.5734 0.8761 0.8761 2.4198 2.4198 3.3847 3.3847 3.5890 3.5890 3.7003 3.7003 4.3413 4.3413 4.6462 4.6462 4.9771 4.9771 6.1937 6.1937 8.0800 8.0800 12.2743 12.2743 14.3032 14.3032 19.3600 19.3600 k = 0.0727 0.0345 0.3280 ( 4514 PWs) bands (ev): -37.3570 -37.3570 -12.1614 -12.1614 -11.2064 -11.2064 0.5731 0.5731 0.8755 0.8755 2.4098 2.4098 3.3612 3.3612 3.6001 3.6001 3.7031 3.7031 4.3073 4.3073 4.6426 4.6426 5.0000 5.0000 6.1781 6.1781 8.0796 8.0796 12.3025 12.3025 14.3438 14.3438 19.2934 19.2934 k = 0.0818 0.0388 0.3280 ( 4514 PWs) bands (ev): -37.3569 -37.3569 -12.1555 -12.1555 -11.2030 -11.2030 0.5726 0.5726 0.8749 0.8749 2.3986 2.3986 3.3355 3.3355 3.6111 3.6111 3.7064 3.7064 4.2732 4.2732 4.6385 4.6385 5.0223 5.0223 6.1612 6.1612 8.0791 8.0791 12.3340 12.3340 14.3891 14.3891 19.2238 19.2238 k = 0.0909 0.0431 0.3280 ( 4508 PWs) bands (ev): -37.3567 -37.3567 -12.1490 -12.1490 -11.1992 -11.1992 0.5721 0.5721 0.8743 0.8743 2.3863 2.3863 3.3075 3.3075 3.6219 3.6219 3.7104 3.7104 4.2394 4.2394 4.6340 4.6340 5.0436 5.0436 6.1432 6.1432 8.0786 8.0786 12.3685 12.3685 14.4387 14.4387 19.1517 19.1517 k = 0.1000 0.0474 0.3280 ( 4504 PWs) bands (ev): -37.3565 -37.3565 -12.1418 -12.1418 -11.1950 -11.1950 0.5713 0.5713 0.8735 0.8735 2.3730 2.3730 3.2770 3.2770 3.6323 3.6323 3.7150 3.7150 4.2064 4.2064 4.6291 4.6291 5.0636 5.0636 6.1243 6.1243 8.0780 8.0780 12.4059 12.4059 14.4925 14.4925 19.0773 19.0773 k = 0.1091 0.0517 0.3280 ( 4494 PWs) bands (ev): -37.3563 -37.3563 -12.1341 -12.1341 -11.1906 -11.1906 0.5704 0.5704 0.8727 0.8727 2.3587 2.3587 3.2440 3.2440 3.6423 3.6423 3.7205 3.7205 4.1744 4.1744 4.6237 4.6237 5.0822 5.0822 6.1050 6.1050 8.0773 8.0773 12.4459 12.4459 14.5501 14.5501 19.0008 19.0008 k = 0.1182 0.0560 0.3280 ( 4489 PWs) bands (ev): -37.3561 -37.3561 -12.1258 -12.1258 -11.1857 -11.1857 0.5693 0.5693 0.8718 0.8718 2.3435 2.3435 3.2085 3.2085 3.6519 3.6519 3.7268 3.7268 4.1437 4.1437 4.6179 4.6179 5.0991 5.0991 6.0854 6.0854 8.0767 8.0767 12.4882 12.4882 14.6113 14.6113 18.9226 18.9226 k = 0.1272 0.0603 0.3280 ( 4488 PWs) bands (ev): -37.3559 -37.3559 -12.1169 -12.1169 -11.1806 -11.1806 0.5680 0.5680 0.8709 0.8709 2.3275 2.3275 3.1704 3.1704 3.6608 3.6608 3.7341 3.7341 4.1146 4.1146 4.6117 4.6117 5.1142 5.1142 6.0659 6.0659 8.0759 8.0759 12.5327 12.5327 14.6756 14.6756 18.8429 18.8429 k = 0.1363 0.0646 0.3280 ( 4478 PWs) bands (ev): -37.3557 -37.3557 -12.1075 -12.1075 -11.1752 -11.1752 0.5664 0.5664 0.8699 0.8699 2.3106 2.3106 3.1299 3.1299 3.6691 3.6691 3.7423 3.7423 4.0870 4.0870 4.6051 4.6051 5.1273 5.1273 6.0470 6.0470 8.0752 8.0752 12.5790 12.5790 14.7428 14.7428 18.7620 18.7620 k = 0.1454 0.0689 0.3280 ( 4479 PWs) bands (ev): -37.3555 -37.3555 -12.0975 -12.0975 -11.1695 -11.1695 0.5645 0.5645 0.8688 0.8688 2.2931 2.2931 3.0871 3.0871 3.6768 3.6768 3.7514 3.7514 4.0611 4.0611 4.5981 4.5981 5.1384 5.1384 6.0288 6.0288 8.0744 8.0744 12.6268 12.6268 14.8126 14.8126 18.6802 18.6802 k = 0.1545 0.0732 0.3280 ( 4477 PWs) bands (ev): -37.3552 -37.3552 -12.0871 -12.0871 -11.1635 -11.1635 0.5623 0.5623 0.8677 0.8677 2.2748 2.2748 3.0422 3.0422 3.6839 3.6839 3.7613 3.7613 4.0369 4.0369 4.5908 4.5908 5.1472 5.1472 6.0117 6.0117 8.0736 8.0736 12.6759 12.6759 14.8846 14.8846 18.5978 18.5978 k = 0.1636 0.0775 0.3280 ( 4490 PWs) bands (ev): -37.3550 -37.3550 -12.0763 -12.0763 -11.1572 -11.1572 0.5597 0.5597 0.8665 0.8665 2.2560 2.2560 2.9954 2.9954 3.6906 3.6906 3.7719 3.7719 4.0144 4.0144 4.5832 4.5832 5.1538 5.1538 5.9960 5.9960 8.0727 8.0727 12.7259 12.7259 14.9585 14.9585 18.5150 18.5150 k = 0.1727 0.0819 0.3280 ( 4488 PWs) bands (ev): -37.3547 -37.3547 -12.0650 -12.0650 -11.1508 -11.1508 0.5568 0.5568 0.8652 0.8652 2.2365 2.2365 2.9470 2.9470 3.6969 3.6969 3.7831 3.7831 3.9934 3.9934 4.5753 4.5753 5.1580 5.1580 5.9821 5.9821 8.0718 8.0718 12.7764 12.7764 15.0339 15.0339 18.4322 18.4322 k = 0.1818 0.0862 0.3280 ( 4490 PWs) bands (ev): -37.3544 -37.3544 -12.0533 -12.0533 -11.1441 -11.1441 0.5534 0.5534 0.8639 0.8639 2.2165 2.2165 2.8973 2.8973 3.7029 3.7029 3.7946 3.7946 3.9740 3.9740 4.5670 4.5670 5.1598 5.1598 5.9700 5.9700 8.0709 8.0709 12.8273 12.8273 15.1106 15.1106 18.3498 18.3498 k = 0.1909 0.0905 0.3280 ( 4476 PWs) bands (ev): -37.3541 -37.3541 -12.0413 -12.0413 -11.1372 -11.1372 0.5496 0.5496 0.8625 0.8625 2.1959 2.1959 2.8466 2.8466 3.7088 3.7088 3.8064 3.8064 3.9559 3.9559 4.5585 4.5585 5.1592 5.1592 5.9601 5.9601 8.0700 8.0700 12.8781 12.8781 15.1881 15.1881 18.2680 18.2680 k = 0.1999 0.0948 0.3280 ( 4472 PWs) bands (ev): -37.3538 -37.3538 -12.0289 -12.0289 -11.1302 -11.1302 0.5454 0.5454 0.8611 0.8611 2.1749 2.1749 2.7952 2.7952 3.7145 3.7145 3.8183 3.8183 3.9393 3.9393 4.5497 4.5497 5.1563 5.1563 5.9524 5.9524 8.0690 8.0690 12.9286 12.9286 15.2662 15.2662 18.1873 18.1873 k = 0.2090 0.0991 0.3280 ( 4470 PWs) bands (ev): -37.3535 -37.3535 -12.0163 -12.0163 -11.1230 -11.1230 0.5407 0.5407 0.8597 0.8597 2.1533 2.1533 2.7434 2.7434 3.7202 3.7202 3.8302 3.8302 3.9239 3.9239 4.5407 4.5407 5.1513 5.1513 5.9469 5.9469 8.0680 8.0680 12.9783 12.9783 15.3445 15.3445 18.1079 18.1079 k = 0.2181 0.1034 0.3280 ( 4470 PWs) bands (ev): -37.3532 -37.3532 -12.0035 -12.0035 -11.1157 -11.1157 0.5356 0.5356 0.8582 0.8582 2.1313 2.1313 2.6915 2.6915 3.7258 3.7258 3.8419 3.8419 3.9099 3.9099 4.5315 4.5315 5.1442 5.1442 5.9436 5.9436 8.0670 8.0670 13.0270 13.0270 15.4228 15.4228 18.0303 18.0303 k = 0.2272 0.1077 0.3280 ( 4484 PWs) bands (ev): -37.3529 -37.3529 -11.9904 -11.9904 -11.1083 -11.1083 0.5299 0.5299 0.8566 0.8566 2.1087 2.1087 2.6399 2.6399 3.7314 3.7314 3.8530 3.8530 3.8974 3.8974 4.5221 4.5221 5.1354 5.1354 5.9426 5.9426 8.0660 8.0660 13.0743 13.0743 15.5006 15.5006 17.9547 17.9547 k = 0.2363 0.1120 0.3280 ( 4476 PWs) bands (ev): -37.3526 -37.3526 -11.9772 -11.9772 -11.1008 -11.1008 0.5238 0.5238 0.8551 0.8551 2.0857 2.0857 2.5888 2.5888 3.7369 3.7369 3.8622 3.8622 3.8878 3.8878 4.5125 4.5125 5.1250 5.1250 5.9436 5.9436 8.0650 8.0650 13.1200 13.1200 15.5777 15.5777 17.8816 17.8816 k = 0.2454 0.1163 0.3280 ( 4472 PWs) bands (ev): -37.3523 -37.3523 -11.9638 -11.9638 -11.0932 -11.0932 0.5172 0.5172 0.8535 0.8535 2.0620 2.0620 2.5386 2.5386 3.7424 3.7424 3.8637 3.8637 3.8866 3.8866 4.5028 4.5028 5.1133 5.1133 5.9464 5.9464 8.0640 8.0640 13.1637 13.1637 15.6538 15.6538 17.8112 17.8112 k = 0.2545 0.1206 0.3280 ( 4466 PWs) bands (ev): -37.3520 -37.3520 -11.9504 -11.9504 -11.0857 -11.0857 0.5101 0.5101 0.8519 0.8519 2.0378 2.0378 2.4896 2.4896 3.7477 3.7477 3.8569 3.8569 3.8945 3.8945 4.4930 4.4930 5.1006 5.1006 5.9511 5.9511 8.0630 8.0630 13.2051 13.2051 15.7286 15.7286 17.7439 17.7439 k = 0.2636 0.1249 0.3280 ( 4468 PWs) bands (ev): -37.3517 -37.3517 -11.9369 -11.9369 -11.0781 -11.0781 0.5025 0.5025 0.8503 0.8503 2.0130 2.0130 2.4420 2.4420 3.7529 3.7529 3.8485 3.8485 3.9046 3.9046 4.4831 4.4831 5.0871 5.0871 5.9572 5.9572 8.0620 8.0620 13.2440 13.2440 15.8018 15.8018 17.6799 17.6799 k = 0.2727 0.1292 0.3280 ( 4468 PWs) bands (ev): -37.3514 -37.3514 -11.9234 -11.9234 -11.0705 -11.0705 0.4945 0.4945 0.8487 0.8487 1.9874 1.9874 2.3962 2.3962 3.7578 3.7578 3.8404 3.8404 3.9152 3.9152 4.4731 4.4731 5.0731 5.0731 5.9647 5.9647 8.0610 8.0610 13.2801 13.2801 15.8732 15.8732 17.6194 17.6194 k = 0.2817 0.1336 0.3280 ( 4468 PWs) bands (ev): -37.3511 -37.3511 -11.9100 -11.9100 -11.0630 -11.0630 0.4860 0.4860 0.8471 0.8471 1.9612 1.9612 2.3523 2.3523 3.7622 3.7622 3.8332 3.8332 3.9256 3.9256 4.4630 4.4630 5.0588 5.0588 5.9734 5.9734 8.0600 8.0600 13.3133 13.3133 15.9426 15.9426 17.5626 17.5626 k = 0.2908 0.1379 0.3280 ( 4468 PWs) bands (ev): -37.3508 -37.3508 -11.8967 -11.8967 -11.0556 -11.0556 0.4772 0.4772 0.8454 0.8454 1.9342 1.9342 2.3108 2.3108 3.7659 3.7659 3.8273 3.8273 3.9359 3.9359 4.4530 4.4530 5.0444 5.0444 5.9830 5.9830 8.0590 8.0590 13.3434 13.3434 16.0096 16.0096 17.5098 17.5098 k = 0.2999 0.1422 0.3280 ( 4466 PWs) bands (ev): -37.3505 -37.3505 -11.8835 -11.8835 -11.0483 -11.0483 0.4680 0.4680 0.8438 0.8438 1.9065 1.9065 2.2716 2.2716 3.7686 3.7686 3.8230 3.8230 3.9458 3.9458 4.4429 4.4429 5.0301 5.0301 5.9935 5.9935 8.0581 8.0581 13.3703 13.3703 16.0742 16.0742 17.4609 17.4609 k = 0.3090 0.1465 0.3280 ( 4468 PWs) bands (ev): -37.3502 -37.3502 -11.8705 -11.8705 -11.0411 -11.0411 0.4585 0.4585 0.8423 0.8423 1.8780 1.8780 2.2350 2.2350 3.7698 3.7698 3.8207 3.8207 3.9553 3.9553 4.4329 4.4329 5.0160 5.0160 6.0046 6.0046 8.0571 8.0571 13.3940 13.3940 16.1362 16.1362 17.4159 17.4159 k = 0.3181 0.1508 0.3280 ( 4468 PWs) bands (ev): -37.3499 -37.3499 -11.8577 -11.8577 -11.0340 -11.0340 0.4487 0.4487 0.8407 0.8407 1.8491 1.8491 2.2010 2.2010 3.7694 3.7694 3.8204 3.8204 3.9644 3.9644 4.4230 4.4230 5.0023 5.0023 6.0162 6.0162 8.0562 8.0562 13.4143 13.4143 16.1954 16.1954 17.3749 17.3749 k = 0.3272 0.1551 0.3280 ( 4472 PWs) bands (ev): -37.3497 -37.3497 -11.8452 -11.8452 -11.0271 -11.0271 0.4387 0.4387 0.8392 0.8392 1.8196 1.8196 2.1696 2.1696 3.7677 3.7677 3.8221 3.8221 3.9731 3.9731 4.4132 4.4132 4.9890 4.9890 6.0282 6.0282 8.0553 8.0553 13.4313 13.4313 16.2519 16.2519 17.3377 17.3377 k = 0.3363 0.1594 0.3280 ( 4472 PWs) bands (ev): -37.3494 -37.3494 -11.8330 -11.8330 -11.0204 -11.0204 0.4287 0.4287 0.8377 0.8377 1.7900 1.7900 2.1408 2.1408 3.7649 3.7649 3.8252 3.8252 3.9814 3.9814 4.4035 4.4035 4.9763 4.9763 6.0404 6.0404 8.0545 8.0545 13.4452 13.4452 16.3055 16.3055 17.3040 17.3040 k = 0.3454 0.1637 0.3280 ( 4483 PWs) bands (ev): -37.3491 -37.3491 -11.8212 -11.8212 -11.0139 -11.0139 0.4185 0.4185 0.8363 0.8363 1.7603 1.7603 2.1144 2.1144 3.7616 3.7616 3.8293 3.8293 3.9892 3.9892 4.3939 4.3939 4.9641 4.9641 6.0526 6.0526 8.0536 8.0536 13.4560 13.4560 16.3562 16.3562 17.2737 17.2737 k = 0.3545 0.1680 0.3280 ( 4482 PWs) bands (ev): -37.3489 -37.3489 -11.8098 -11.8098 -11.0077 -11.0077 0.4084 0.4084 0.8349 0.8349 1.7310 1.7310 2.0904 2.0904 3.7580 3.7580 3.8339 3.8339 3.9966 3.9966 4.3846 4.3846 4.9527 4.9527 6.0649 6.0649 8.0528 8.0528 13.4640 13.4640 16.4042 16.4042 17.2464 17.2464 k = 0.3635 0.1723 0.3280 ( 4474 PWs) bands (ev): -37.3486 -37.3486 -11.7988 -11.7988 -11.0017 -11.0017 0.3983 0.3983 0.8336 0.8336 1.7021 1.7021 2.0686 2.0686 3.7544 3.7544 3.8390 3.8390 4.0035 4.0035 4.3755 4.3755 4.9420 4.9420 6.0771 6.0771 8.0521 8.0521 13.4694 13.4694 16.4496 16.4496 17.2218 17.2218 k = 0.3726 0.1766 0.3280 ( 4481 PWs) bands (ev): -37.3484 -37.3484 -11.7883 -11.7883 -10.9960 -10.9960 0.3885 0.3885 0.8323 0.8323 1.6741 1.6741 2.0488 2.0488 3.7510 3.7510 3.8442 3.8442 4.0098 4.0098 4.3667 4.3667 4.9319 4.9319 6.0890 6.0890 8.0513 8.0513 13.4724 13.4724 16.4923 16.4923 17.1994 17.1994 k = 0.3817 0.1809 0.3280 ( 4482 PWs) bands (ev): -37.3482 -37.3482 -11.7784 -11.7784 -10.9906 -10.9906 0.3788 0.3788 0.8311 0.8311 1.6471 1.6471 2.0309 2.0309 3.7477 3.7477 3.8494 3.8494 4.0158 4.0158 4.3582 4.3582 4.9226 4.9226 6.1005 6.1005 8.0506 8.0506 13.4733 13.4733 16.5327 16.5327 17.1789 17.1789 k = 0.3908 0.1853 0.3280 ( 4486 PWs) bands (ev): -37.3480 -37.3480 -11.7690 -11.7690 -10.9855 -10.9855 0.3695 0.3695 0.8300 0.8300 1.6213 1.6213 2.0147 2.0147 3.7446 3.7446 3.8546 3.8546 4.0212 4.0212 4.3501 4.3501 4.9141 4.9141 6.1116 6.1116 8.0500 8.0500 13.4724 13.4724 16.5708 16.5708 17.1599 17.1599 k = 0.3999 0.1896 0.3280 ( 4484 PWs) bands (ev): -37.3478 -37.3478 -11.7603 -11.7603 -10.9807 -10.9807 0.3606 0.3606 0.8289 0.8289 1.5970 1.5970 2.0001 2.0001 3.7418 3.7418 3.8597 3.8597 4.0262 4.0262 4.3424 4.3424 4.9063 4.9063 6.1223 6.1223 8.0494 8.0494 13.4701 13.4701 16.6068 16.6068 17.1419 17.1419 k = 0.4090 0.1939 0.3280 ( 4482 PWs) bands (ev): -37.3476 -37.3476 -11.7521 -11.7521 -10.9764 -10.9764 0.3522 0.3522 0.8280 0.8280 1.5743 1.5743 1.9871 1.9871 3.7393 3.7393 3.8646 3.8646 4.0306 4.0306 4.3351 4.3351 4.8992 4.8992 6.1322 6.1322 8.0489 8.0489 13.4667 13.4667 16.6409 16.6409 17.1246 17.1246 k = 0.4181 0.1982 0.3280 ( 4482 PWs) bands (ev): -37.3475 -37.3475 -11.7447 -11.7447 -10.9723 -10.9723 0.3443 0.3443 0.8271 0.8271 1.5534 1.5534 1.9756 1.9756 3.7370 3.7370 3.8692 3.8692 4.0347 4.0347 4.3284 4.3284 4.8929 4.8929 6.1415 6.1415 8.0483 8.0483 13.4625 13.4625 16.6732 16.6732 17.1078 17.1078 k = 0.4272 0.2025 0.3280 ( 4474 PWs) bands (ev): -37.3473 -37.3473 -11.7379 -11.7379 -10.9687 -10.9687 0.3370 0.3370 0.8263 0.8263 1.5344 1.5344 1.9654 1.9654 3.7350 3.7350 3.8736 3.8736 4.0382 4.0382 4.3222 4.3222 4.8873 4.8873 6.1501 6.1501 8.0479 8.0479 13.4578 13.4578 16.7038 16.7038 17.0912 17.0912 k = 0.4363 0.2068 0.3280 ( 4484 PWs) bands (ev): -37.3472 -37.3472 -11.7319 -11.7319 -10.9655 -10.9655 0.3305 0.3305 0.8255 0.8255 1.5174 1.5174 1.9565 1.9565 3.7333 3.7333 3.8776 3.8776 4.0414 4.0414 4.3165 4.3165 4.8824 4.8824 6.1578 6.1578 8.0475 8.0475 13.4529 13.4529 16.7329 16.7329 17.0746 17.0746 k = 0.4453 0.2111 0.3280 ( 4482 PWs) bands (ev): -37.3471 -37.3471 -11.7266 -11.7266 -10.9626 -10.9626 0.3246 0.3246 0.8249 0.8249 1.5025 1.5025 1.9489 1.9489 3.7318 3.7318 3.8812 3.8812 4.0441 4.0441 4.3115 4.3115 4.8782 4.8782 6.1646 6.1646 8.0471 8.0471 13.4481 13.4481 16.7603 16.7603 17.0581 17.0581 k = 0.4544 0.2154 0.3280 ( 4486 PWs) bands (ev): -37.3470 -37.3470 -11.7221 -11.7221 -10.9602 -10.9602 0.3196 0.3196 0.8244 0.8244 1.4897 1.4897 1.9425 1.9425 3.7306 3.7306 3.8843 3.8843 4.0463 4.0463 4.3072 4.3072 4.8746 4.8746 6.1704 6.1704 8.0468 8.0468 13.4436 13.4436 16.7860 16.7860 17.0416 17.0416 k = 0.4635 0.2197 0.3280 ( 4480 PWs) bands (ev): -37.3469 -37.3469 -11.7184 -11.7184 -10.9582 -10.9582 0.3154 0.3154 0.8239 0.8239 1.4792 1.4792 1.9373 1.9373 3.7295 3.7295 3.8869 3.8869 4.0482 4.0482 4.3036 4.3036 4.8717 4.8717 6.1753 6.1753 8.0466 8.0466 13.4396 13.4396 16.8097 16.8097 17.0254 17.0254 k = 0.4726 0.2240 0.3280 ( 4480 PWs) bands (ev): -37.3469 -37.3469 -11.7154 -11.7154 -10.9567 -10.9567 0.3121 0.3121 0.8236 0.8236 1.4710 1.4710 1.9333 1.9333 3.7288 3.7288 3.8890 3.8890 4.0496 4.0496 4.3008 4.3008 4.8695 4.8695 6.1791 6.1791 8.0464 8.0464 13.4363 13.4363 16.8309 16.8309 17.0101 17.0101 k = 0.4817 0.2283 0.3280 ( 4481 PWs) bands (ev): -37.3468 -37.3468 -11.7133 -11.7133 -10.9556 -10.9556 0.3097 0.3097 0.8233 0.8233 1.4651 1.4651 1.9304 1.9304 3.7282 3.7282 3.8905 3.8905 4.0506 4.0506 4.2987 4.2987 4.8679 4.8679 6.1819 6.1819 8.0463 8.0463 13.4339 13.4339 16.8485 16.8485 16.9967 16.9967 k = 0.4908 0.2326 0.3280 ( 4474 PWs) bands (ev): -37.3468 -37.3468 -11.7121 -11.7121 -10.9549 -10.9549 0.3083 0.3083 0.8232 0.8232 1.4615 1.4615 1.9287 1.9287 3.7279 3.7279 3.8914 3.8914 4.0512 4.0512 4.2975 4.2975 4.8669 4.8669 6.1835 6.1835 8.0462 8.0462 13.4325 13.4325 16.8605 16.8605 16.9871 16.9871 k = 0.4999 0.2370 0.3280 ( 4480 PWs) bands (ev): -37.3468 -37.3468 -11.7117 -11.7117 -10.9547 -10.9547 0.3078 0.3078 0.8231 0.8231 1.4603 1.4603 1.9281 1.9281 3.7278 3.7278 3.8917 3.8917 4.0515 4.0515 4.2970 4.2970 4.8666 4.8666 6.1841 6.1841 8.0462 8.0462 13.4320 13.4320 16.8644 16.8644 16.9840 16.9840 k = 0.5000 0.2370-0.3278 ( 4482 PWs) bands (ev): -37.3468 -37.3468 -11.7117 -11.7117 -10.9547 -10.9547 0.3078 0.3078 0.8231 0.8231 1.4603 1.4603 1.9281 1.9281 3.7278 3.7278 3.8917 3.8917 4.0515 4.0515 4.2970 4.2970 4.8666 4.8666 6.1841 6.1841 8.0462 8.0462 13.4320 13.4320 16.8644 16.8644 16.9840 16.9840 k = 0.5042 0.2281-0.3278 ( 4476 PWs) bands (ev): -37.3468 -37.3468 -11.7111 -11.7111 -10.9545 -10.9545 0.3087 0.3087 0.8226 0.8226 1.4604 1.4604 1.9288 1.9288 3.7212 3.7212 3.8918 3.8918 4.0532 4.0532 4.3012 4.3012 4.8664 4.8664 6.1836 6.1836 8.0430 8.0430 13.4335 13.4335 16.8663 16.8663 16.9853 16.9853 k = 0.5085 0.2191-0.3278 ( 4476 PWs) bands (ev): -37.3467 -37.3467 -11.7096 -11.7096 -10.9541 -10.9541 0.3114 0.3114 0.8209 0.8209 1.4606 1.4606 1.9308 1.9308 3.7019 3.7019 3.8924 3.8924 4.0583 4.0583 4.3129 4.3129 4.8660 4.8660 6.1821 6.1821 8.0336 8.0336 13.4378 13.4378 16.8718 16.8718 16.9890 16.9890 k = 0.5127 0.2101-0.3278 ( 4476 PWs) bands (ev): -37.3466 -37.3466 -11.7070 -11.7070 -10.9534 -10.9534 0.3159 0.3159 0.8180 0.8180 1.4609 1.4609 1.9341 1.9341 3.6711 3.6711 3.8940 3.8940 4.0666 4.0666 4.3307 4.3307 4.8652 4.8652 6.1797 6.1797 8.0181 8.0181 13.4449 13.4449 16.8809 16.8809 16.9953 16.9953 k = 0.5170 0.2012-0.3278 ( 4472 PWs) bands (ev): -37.3465 -37.3465 -11.7034 -11.7034 -10.9524 -10.9524 0.3223 0.3223 0.8142 0.8142 1.4614 1.4614 1.9387 1.9387 3.6303 3.6303 3.8971 3.8971 4.0780 4.0780 4.3526 4.3526 4.8641 4.8641 6.1763 6.1763 7.9965 7.9965 13.4548 13.4548 16.8935 16.8935 17.0040 17.0040 k = 0.5212 0.1922-0.3278 ( 4470 PWs) bands (ev): -37.3464 -37.3464 -11.6988 -11.6988 -10.9512 -10.9512 0.3304 0.3304 0.8093 0.8093 1.4620 1.4620 1.9447 1.9447 3.5812 3.5812 3.9017 3.9017 4.0922 4.0922 4.3771 4.3771 4.8627 4.8627 6.1719 6.1719 7.9692 7.9692 13.4674 13.4674 16.9095 16.9095 17.0150 17.0150 k = 0.5255 0.1833-0.3278 ( 4460 PWs) bands (ev): -37.3462 -37.3462 -11.6932 -11.6932 -10.9497 -10.9497 0.3403 0.3403 0.8036 0.8036 1.4627 1.4627 1.9519 1.9519 3.5254 3.5254 3.9081 3.9081 4.1090 4.1090 4.4028 4.4028 4.8610 4.8610 6.1665 6.1665 7.9362 7.9362 13.4826 13.4826 16.9287 16.9287 17.0283 17.0283 k = 0.5297 0.1743-0.3278 ( 4466 PWs) bands (ev): -37.3460 -37.3460 -11.6866 -11.6866 -10.9479 -10.9479 0.3520 0.3520 0.7970 0.7970 1.4636 1.4636 1.9605 1.9605 3.4640 3.4640 3.9161 3.9161 4.1282 4.1282 4.4286 4.4286 4.8590 4.8590 6.1601 6.1601 7.8981 7.8981 13.5001 13.5001 16.9508 16.9508 17.0438 17.0438 k = 0.5340 0.1653-0.3278 ( 4474 PWs) bands (ev): -37.3458 -37.3458 -11.6790 -11.6790 -10.9459 -10.9459 0.3655 0.3655 0.7897 0.7897 1.4645 1.4645 1.9703 1.9703 3.3979 3.3979 3.9257 3.9257 4.1496 4.1496 4.4538 4.4538 4.8567 4.8567 6.1527 6.1527 7.8551 7.8551 13.5200 13.5200 16.9757 16.9757 17.0615 17.0615 k = 0.5382 0.1564-0.3278 ( 4476 PWs) bands (ev): -37.3456 -37.3456 -11.6705 -11.6705 -10.9436 -10.9436 0.3807 0.3807 0.7819 0.7819 1.4655 1.4655 1.9814 1.9814 3.3277 3.3277 3.9371 3.9371 4.1728 4.1728 4.4779 4.4779 4.8542 4.8542 6.1443 6.1443 7.8075 7.8075 13.5419 13.5419 17.0028 17.0028 17.0811 17.0811 k = 0.5425 0.1474-0.3278 ( 4476 PWs) bands (ev): -37.3453 -37.3453 -11.6610 -11.6610 -10.9411 -10.9411 0.3976 0.3976 0.7737 0.7737 1.4666 1.4666 1.9938 1.9938 3.2541 3.2541 3.9501 3.9501 4.1977 4.1977 4.5006 4.5006 4.8514 4.8514 6.1348 6.1348 7.7560 7.7560 13.5658 13.5658 17.0321 17.0321 17.1025 17.1025 k = 0.5467 0.1385-0.3278 ( 4482 PWs) bands (ev): -37.3450 -37.3450 -11.6507 -11.6507 -10.9383 -10.9383 0.4161 0.4161 0.7651 0.7651 1.4678 1.4678 2.0074 2.0074 3.1775 3.1775 3.9647 3.9647 4.2239 4.2239 4.5216 4.5216 4.8484 4.8484 6.1243 6.1243 7.7008 7.7008 13.5915 13.5915 17.0630 17.0630 17.1258 17.1258 k = 0.5510 0.1295-0.3278 ( 4494 PWs) bands (ev): -37.3447 -37.3447 -11.6394 -11.6394 -10.9353 -10.9353 0.4364 0.4364 0.7564 0.7564 1.4691 1.4691 2.0222 2.0222 3.0982 3.0982 3.9809 3.9809 4.2511 4.2511 4.5408 4.5408 4.8452 4.8452 6.1127 6.1127 7.6425 7.6425 13.6188 13.6188 17.0951 17.0951 17.1507 17.1507 k = 0.5552 0.1206-0.3278 ( 4490 PWs) bands (ev): -37.3444 -37.3444 -11.6273 -11.6273 -10.9321 -10.9321 0.4582 0.4582 0.7478 0.7478 1.4705 1.4705 2.0382 2.0382 3.0166 3.0166 3.9988 3.9988 4.2790 4.2790 4.5580 4.5580 4.8418 4.8418 6.1001 6.1001 7.5817 7.5817 13.6475 13.6475 17.1281 17.1281 17.1771 17.1771 k = 0.5595 0.1116-0.3278 ( 4492 PWs) bands (ev): -37.3440 -37.3440 -11.6144 -11.6144 -10.9287 -10.9287 0.4815 0.4815 0.7393 0.7393 1.4719 1.4719 2.0552 2.0552 2.9330 2.9330 4.0182 4.0182 4.3072 4.3072 4.5731 4.5731 4.8382 4.8382 6.0864 6.0864 7.5188 7.5188 13.6776 13.6776 17.1614 17.1614 17.2050 17.2050 k = 0.5637 0.1026-0.3278 ( 4492 PWs) bands (ev): -37.3436 -37.3436 -11.6007 -11.6007 -10.9251 -10.9251 0.5062 0.5062 0.7313 0.7313 1.4735 1.4735 2.0734 2.0734 2.8477 2.8477 4.0392 4.0392 4.3352 4.3352 4.5861 4.5861 4.8345 4.8345 6.0717 6.0717 7.4545 7.4545 13.7087 13.7087 17.1946 17.1946 17.2343 17.2343 k = 0.5679 0.0937-0.3278 ( 4488 PWs) bands (ev): -37.3432 -37.3432 -11.5863 -11.5863 -10.9213 -10.9213 0.5322 0.5322 0.7240 0.7240 1.4751 1.4751 2.0924 2.0924 2.7611 2.7611 4.0617 4.0617 4.3627 4.3627 4.5969 4.5969 4.8307 4.8307 6.0558 6.0558 7.3894 7.3894 13.7409 13.7409 17.2270 17.2270 17.2648 17.2648 k = 0.5722 0.0847-0.3278 ( 4486 PWs) bands (ev): -37.3428 -37.3428 -11.5711 -11.5711 -10.9173 -10.9173 0.5591 0.5591 0.7178 0.7178 1.4768 1.4768 2.1123 2.1123 2.6735 2.6735 4.0857 4.0857 4.3890 4.3890 4.6056 4.6056 4.8269 4.8269 6.0389 6.0389 7.3242 7.3242 13.7739 13.7739 17.2581 17.2581 17.2966 17.2966 k = 0.5764 0.0758-0.3278 ( 4490 PWs) bands (ev): -37.3423 -37.3423 -11.5553 -11.5553 -10.9131 -10.9131 0.5864 0.5864 0.7134 0.7134 1.4786 1.4786 2.1325 2.1325 2.5855 2.5855 4.1110 4.1110 4.4138 4.4138 4.6121 4.6121 4.8230 4.8230 6.0210 6.0210 7.2595 7.2595 13.8076 13.8076 17.2872 17.2872 17.3296 17.3296 k = 0.5807 0.0668-0.3278 ( 4492 PWs) bands (ev): -37.3419 -37.3419 -11.5389 -11.5389 -10.9088 -10.9088 0.6128 0.6128 0.7121 0.7121 1.4805 1.4805 2.1525 2.1525 2.4980 2.4980 4.1377 4.1377 4.4365 4.4365 4.6165 4.6165 4.8190 4.8190 6.0020 6.0020 7.1960 7.1960 13.8419 13.8419 17.3136 17.3136 17.3637 17.3637 k = 0.5849 0.0578-0.3278 ( 4480 PWs) bands (ev): -37.3414 -37.3414 -11.5219 -11.5219 -10.9043 -10.9043 0.6356 0.6356 0.7167 0.7167 1.4825 1.4825 2.1701 2.1701 2.4132 2.4132 4.1656 4.1656 4.4563 4.4563 4.6188 4.6188 4.8150 4.8150 5.9820 5.9820 7.1345 7.1345 13.8766 13.8766 17.3364 17.3364 17.3990 17.3990 k = 0.5892 0.0489-0.3278 ( 4484 PWs) bands (ev): -37.3409 -37.3409 -11.5044 -11.5044 -10.8997 -10.8997 0.6508 0.6508 0.7313 0.7313 1.4846 1.4846 2.1783 2.1783 2.3386 2.3386 4.1946 4.1946 4.4728 4.4728 4.6193 4.6193 4.8108 4.8108 5.9610 5.9610 7.0757 7.0757 13.9117 13.9117 17.3546 17.3546 17.4354 17.4354 k = 0.5934 0.0399-0.3278 ( 4476 PWs) bands (ev): -37.3404 -37.3404 -11.4864 -11.4864 -10.8950 -10.8950 0.6580 0.6580 0.7563 0.7563 1.4869 1.4869 2.1544 2.1544 2.2967 2.2967 4.2247 4.2247 4.4852 4.4852 4.6180 4.6180 4.8065 4.8065 5.9390 5.9390 7.0204 7.0204 13.9471 13.9471 17.3671 17.3671 17.4730 17.4730 k = 0.5977 0.0310-0.3278 ( 4474 PWs) bands (ev): -37.3399 -37.3399 -11.4680 -11.4680 -10.8902 -10.8902 0.6609 0.6609 0.7881 0.7881 1.4894 1.4894 2.0887 2.0887 2.2975 2.2975 4.2555 4.2555 4.4929 4.4929 4.6152 4.6152 4.8020 4.8020 5.9161 5.9161 6.9693 6.9693 13.9826 13.9826 17.3726 17.3726 17.5117 17.5117 k = 0.6019 0.0220-0.3278 ( 4472 PWs) bands (ev): -37.3394 -37.3394 -11.4493 -11.4493 -10.8853 -10.8853 0.6625 0.6625 0.8238 0.8238 1.4920 1.4920 2.0060 2.0060 2.3166 2.3166 4.2867 4.2867 4.4953 4.4953 4.6112 4.6112 4.7971 4.7971 5.8924 5.8924 6.9232 6.9232 14.0182 14.0182 17.3701 17.3701 17.5517 17.5517 k = 0.6062 0.0131-0.3278 ( 4474 PWs) bands (ev): -37.3389 -37.3389 -11.4303 -11.4303 -10.8804 -10.8804 0.6641 0.6641 0.8621 0.8621 1.4947 1.4947 1.9184 1.9184 2.3419 2.3419 4.3177 4.3177 4.4921 4.4921 4.6066 4.6066 4.7918 4.7918 5.8678 5.8678 6.8827 6.8827 14.0539 14.0539 17.3589 17.3589 17.5928 17.5928 k = 0.6104 0.0041-0.3278 ( 4478 PWs) bands (ev): -37.3383 -37.3383 -11.4110 -11.4110 -10.8753 -10.8753 0.6664 0.6664 0.9023 0.9023 1.4977 1.4977 1.8293 1.8293 2.3700 2.3700 4.3476 4.3476 4.4832 4.4832 4.6018 4.6018 4.7859 4.7859 5.8425 5.8425 6.8484 6.8484 14.0894 14.0894 17.3392 17.3392 17.6238 17.6238 k = 0.6147-0.0049-0.3278 ( 4488 PWs) bands (ev): -37.3378 -37.3378 -11.3916 -11.3916 -10.8702 -10.8702 0.6698 0.6698 0.9441 0.9441 1.5009 1.5009 1.7400 1.7400 2.4000 2.4000 4.3742 4.3742 4.4693 4.4693 4.5981 4.5981 4.7794 4.7794 5.8165 5.8165 6.8206 6.8206 14.1248 14.1248 17.3121 17.3121 17.6069 17.6069 k = 0.6189-0.0138-0.3278 ( 4488 PWs) bands (ev): -37.3373 -37.3373 -11.3720 -11.3720 -10.8651 -10.8651 0.6745 0.6745 0.9873 0.9873 1.5043 1.5043 1.6512 1.6512 2.4314 2.4314 4.3914 4.3914 4.4542 4.4542 4.5973 4.5973 4.7722 4.7722 5.7898 5.7898 6.7997 6.7997 14.1600 14.1600 17.2792 17.2792 17.5901 17.5901 k = 0.6232-0.0228-0.3278 ( 4480 PWs) bands (ev): -37.3368 -37.3368 -11.3525 -11.3525 -10.8600 -10.8600 0.6806 0.6806 1.0316 1.0316 1.5075 1.5075 1.5635 1.5635 2.4639 2.4639 4.3861 4.3861 4.4483 4.4483 4.6025 4.6025 4.7642 4.7642 5.7627 5.7627 6.7857 6.7857 14.1951 14.1951 17.2418 17.2418 17.5725 17.5725 k = 0.6274-0.0317-0.3278 ( 4480 PWs) bands (ev): -37.3362 -37.3362 -11.3330 -11.3330 -10.8549 -10.8549 0.6884 0.6884 1.0770 1.0770 1.4747 1.4747 1.5133 1.5133 2.4974 2.4974 4.3573 4.3573 4.4496 4.4496 4.6164 4.6164 4.7552 4.7552 5.7351 5.7351 6.7786 6.7786 14.2298 14.2298 17.2014 17.2014 17.5527 17.5527 k = 0.6316-0.0407-0.3278 ( 4480 PWs) bands (ev): -37.3357 -37.3357 -11.3136 -11.3136 -10.8498 -10.8498 0.6978 0.6978 1.1233 1.1233 1.3898 1.3898 1.5169 1.5169 2.5318 2.5318 4.3163 4.3163 4.4467 4.4467 4.6395 4.6395 4.7454 4.7454 5.7072 5.7072 6.7781 6.7781 14.2643 14.2643 17.1587 17.1587 17.5299 17.5299 k = 0.6359-0.0497-0.3278 ( 4484 PWs) bands (ev): -37.3352 -37.3352 -11.2943 -11.2943 -10.8447 -10.8447 0.7089 0.7089 1.1703 1.1703 1.3061 1.3061 1.5214 1.5214 2.5670 2.5670 4.2674 4.2674 4.4373 4.4373 4.6699 4.6699 4.7349 4.7349 5.6791 5.6791 6.7838 6.7838 14.2985 14.2985 17.1145 17.1145 17.5036 17.5036 k = 0.6401-0.0586-0.3278 ( 4486 PWs) bands (ev): -37.3347 -37.3347 -11.2754 -11.2754 -10.8396 -10.8396 0.7218 0.7218 1.2104 1.2104 1.2318 1.2318 1.5263 1.5263 2.6029 2.6029 4.2121 4.2121 4.4230 4.4230 4.7029 4.7029 4.7256 4.7256 5.6508 5.6508 6.7953 6.7953 14.3324 14.3324 17.0691 17.0691 17.4735 17.4735 k = 0.6444-0.0676-0.3278 ( 4492 PWs) bands (ev): -37.3342 -37.3342 -11.2568 -11.2568 -10.8346 -10.8346 0.7366 0.7366 1.1416 1.1416 1.2689 1.2689 1.5317 1.5317 2.6395 2.6395 4.1514 4.1514 4.4050 4.4050 4.7065 4.7065 4.7480 4.7480 5.6225 5.6225 6.8120 6.8120 14.3660 14.3660 17.0230 17.0230 17.4396 17.4396 k = 0.6486-0.0765-0.3278 ( 4490 PWs) bands (ev): -37.3337 -37.3337 -11.2386 -11.2386 -10.8297 -10.8297 0.7531 0.7531 1.0638 1.0638 1.3178 1.3178 1.5375 1.5375 2.6767 2.6767 4.0858 4.0858 4.3841 4.3841 4.6932 4.6932 4.7884 4.7884 5.5944 5.5944 6.8333 6.8333 14.3994 14.3994 16.9763 16.9763 17.4020 17.4020 k = 0.6529-0.0855-0.3278 ( 4490 PWs) bands (ev): -37.3332 -37.3332 -11.2209 -11.2209 -10.8249 -10.8249 0.7713 0.7713 0.9883 0.9883 1.3673 1.3673 1.5438 1.5438 2.7144 2.7144 4.0162 4.0162 4.3609 4.3609 4.6780 4.6780 4.8312 4.8312 5.5665 5.5665 6.8586 6.8586 14.4326 14.4326 16.9290 16.9290 17.3609 17.3609 k = 0.6571-0.0944-0.3278 ( 4486 PWs) bands (ev): -37.3327 -37.3327 -11.2038 -11.2038 -10.8201 -10.8201 0.7905 0.7905 0.9163 0.9163 1.4171 1.4171 1.5508 1.5508 2.7526 2.7526 3.9430 3.9430 4.3357 4.3357 4.6614 4.6614 4.8753 4.8753 5.5389 5.5389 6.8874 6.8874 14.4655 14.4655 16.8810 16.8810 17.3167 17.3167 k = 0.6614-0.1034-0.3278 ( 4494 PWs) bands (ev): -37.3323 -37.3323 -11.1873 -11.1873 -10.8155 -10.8155 0.8040 0.8040 0.8545 0.8545 1.4664 1.4664 1.5589 1.5589 2.7912 2.7912 3.8669 3.8669 4.3086 4.3086 4.6437 4.6437 4.9203 4.9203 5.5119 5.5119 6.9190 6.9190 14.4984 14.4984 16.8324 16.8324 17.2701 17.2701 k = 0.6656-0.1124-0.3278 ( 4486 PWs) bands (ev): -37.3318 -37.3318 -11.1716 -11.1716 -10.8109 -10.8109 0.7657 0.7657 0.8493 0.8493 1.5139 1.5139 1.5695 1.5695 2.8301 2.8301 3.7884 3.7884 4.2800 4.2800 4.6248 4.6248 4.9659 4.9659 5.4855 5.4855 6.9530 6.9530 14.5312 14.5312 16.7828 16.7828 17.2216 17.2216 k = 0.6699-0.1213-0.3278 ( 4482 PWs) bands (ev): -37.3314 -37.3314 -11.1566 -11.1566 -10.8066 -10.8066 0.7035 0.7035 0.8731 0.8731 1.5518 1.5518 1.5901 1.5901 2.8693 2.8693 3.7080 3.7080 4.2498 4.2498 4.6048 4.6048 5.0119 5.0119 5.4598 5.4598 6.9888 6.9888 14.5641 14.5641 16.7319 16.7319 17.1721 17.1721 k = 0.6741-0.1303-0.3278 ( 4482 PWs) bands (ev): -37.3310 -37.3310 -11.1426 -11.1426 -10.8023 -10.8023 0.6418 0.6418 0.9014 0.9014 1.5707 1.5707 1.6301 1.6301 2.9087 2.9087 3.6262 3.6262 4.2182 4.2182 4.5838 4.5838 5.0581 5.0581 5.4351 5.4351 7.0260 7.0260 14.5970 14.5970 16.6793 16.6793 17.1225 17.1225 k = 0.3259-0.6875 0.0000 ( 4482 PWs) bands (ev): -37.3310 -37.3310 -11.1426 -11.1426 -10.8023 -10.8023 0.6418 0.6418 0.9014 0.9014 1.5707 1.5707 1.6301 1.6301 2.9087 2.9087 3.6262 3.6262 4.2182 4.2182 4.5838 4.5838 5.0581 5.0581 5.4351 5.4351 7.0260 7.0260 14.5970 14.5970 16.6793 16.6793 17.1225 17.1225 k = 0.3216-0.6784-0.0000 ( 4474 PWs) bands (ev): -37.3306 -37.3306 -11.1293 -11.1293 -10.7982 -10.7982 0.5822 0.5822 0.9327 0.9327 1.5824 1.5824 1.6781 1.6781 2.9485 2.9485 3.5425 3.5425 4.1848 4.1848 4.5616 4.5616 5.1047 5.1047 5.4112 5.4112 7.0646 7.0646 14.6306 14.6306 16.6240 16.6240 17.0732 17.0732 k = 0.3173-0.6694-0.0000 ( 4472 PWs) bands (ev): -37.3302 -37.3302 -11.1172 -11.1172 -10.7942 -10.7942 0.5256 0.5256 0.9665 0.9665 1.5928 1.5928 1.7273 1.7273 2.9883 2.9883 3.4582 3.4582 4.1503 4.1503 4.5385 4.5385 5.1509 5.1509 5.3886 5.3886 7.1037 7.1037 14.6645 14.6645 16.5660 16.5660 17.0256 17.0256 k = 0.3130-0.6604 0.0000 ( 4464 PWs) bands (ev): -37.3299 -37.3299 -11.1061 -11.1061 -10.7904 -10.7904 0.4725 0.4725 1.0026 1.0026 1.6033 1.6033 1.7763 1.7763 3.0278 3.0278 3.3737 3.3737 4.1146 4.1146 4.5146 4.5146 5.1960 5.1960 5.3681 5.3681 7.1431 7.1431 14.6988 14.6988 16.5050 16.5050 16.9805 16.9805 k = 0.3087-0.6513 0.0000 ( 4468 PWs) bands (ev): -37.3296 -37.3296 -11.0963 -11.0963 -10.7869 -10.7869 0.4228 0.4228 1.0410 1.0410 1.6140 1.6140 1.8247 1.8247 3.0664 3.0664 3.2899 3.2899 4.0780 4.0780 4.4900 4.4900 5.2381 5.2381 5.3513 5.3513 7.1824 7.1824 14.7338 14.7338 16.4407 16.4407 16.9388 16.9388 k = 0.3045-0.6423-0.0000 ( 4468 PWs) bands (ev): -37.3293 -37.3293 -11.0876 -11.0876 -10.7835 -10.7835 0.3768 0.3768 1.0816 1.0816 1.6252 1.6252 1.8719 1.8719 3.1010 3.1010 3.2100 3.2100 4.0405 4.0405 4.4648 4.4648 5.2702 5.2702 5.3452 5.3452 7.2213 7.2213 14.7695 14.7695 16.3730 16.3730 16.9008 16.9008 k = 0.3002-0.6332-0.0000 ( 4460 PWs) bands (ev): -37.3291 -37.3291 -11.0803 -11.0803 -10.7803 -10.7803 0.3346 0.3346 1.1244 1.1244 1.6369 1.6369 1.9178 1.9178 3.0970 3.0970 3.1688 3.1688 4.0025 4.0025 4.4392 4.4392 5.2780 5.2780 5.3641 5.3641 7.2596 7.2596 14.8061 14.8061 16.3021 16.3021 16.8669 16.8669 k = 0.2959-0.6242 0.0000 ( 4464 PWs) bands (ev): -37.3288 -37.3288 -11.0744 -11.0744 -10.7773 -10.7773 0.2962 0.2962 1.1694 1.1694 1.6492 1.6492 1.9618 1.9618 3.0249 3.0249 3.1960 3.1960 3.9642 3.9642 4.4134 4.4134 5.2683 5.2683 5.4009 5.4009 7.2969 7.2969 14.8438 14.8438 16.2281 16.2281 16.8372 16.8372 k = 0.2916-0.6151-0.0000 ( 4464 PWs) bands (ev): -37.3286 -37.3286 -11.0699 -11.0699 -10.7745 -10.7745 0.2618 0.2618 1.2165 1.2165 1.6621 1.6621 2.0037 2.0037 2.9438 2.9438 3.2325 3.2325 3.9258 3.9258 4.3874 4.3874 5.2542 5.2542 5.4424 5.4424 7.3332 7.3332 14.8827 14.8827 16.1514 16.1514 16.8116 16.8116 k = 0.2873-0.6061-0.0000 ( 4468 PWs) bands (ev): -37.3285 -37.3285 -11.0668 -11.0668 -10.7720 -10.7720 0.2314 0.2314 1.2656 1.2656 1.6758 1.6758 2.0430 2.0430 2.8621 2.8621 3.2700 3.2700 3.8877 3.8877 4.3615 4.3615 5.2396 5.2396 5.4848 5.4848 7.3681 7.3681 14.9230 14.9230 16.0724 16.0724 16.7900 16.7900 k = 0.2830-0.5970-0.0000 ( 4470 PWs) bands (ev): -37.3284 -37.3284 -11.0653 -11.0653 -10.7697 -10.7697 0.2051 0.2051 1.3167 1.3167 1.6902 1.6902 2.0793 2.0793 2.7812 2.7812 3.3073 3.3073 3.8503 3.8503 4.3358 4.3358 5.2253 5.2253 5.5270 5.5270 7.4016 7.4016 14.9648 14.9648 15.9915 15.9915 16.7724 16.7724 k = 0.2787-0.5880 0.0000 ( 4476 PWs) bands (ev): -37.3283 -37.3283 -11.0653 -11.0653 -10.7677 -10.7677 0.1829 0.1829 1.3696 1.3696 1.7054 1.7054 2.1121 2.1121 2.7014 2.7014 3.3440 3.3440 3.8138 3.8138 4.3105 4.3105 5.2118 5.2118 5.5684 5.5684 7.4334 7.4334 15.0083 15.0083 15.9089 15.9089 16.7585 16.7585 k = 0.2744-0.5789 0.0000 ( 4472 PWs) bands (ev): -37.3282 -37.3282 -11.0669 -11.0669 -10.7659 -10.7659 0.1649 0.1649 1.4241 1.4241 1.7217 1.7217 2.1409 2.1409 2.6229 2.6229 3.3799 3.3799 3.7788 3.7788 4.2859 4.2859 5.1992 5.1992 5.6088 5.6088 7.4633 7.4633 15.0537 15.0537 15.8252 15.8252 16.7482 16.7482 k = 0.2701-0.5699-0.0000 ( 4476 PWs) bands (ev): -37.3282 -37.3282 -11.0700 -11.0700 -10.7643 -10.7643 0.1512 0.1512 1.4797 1.4797 1.7394 1.7394 2.1653 2.1653 2.5462 2.5462 3.4149 3.4149 3.7455 3.7455 4.2623 4.2623 5.1877 5.1877 5.6479 5.6479 7.4914 7.4914 15.1011 15.1011 15.7405 15.7405 16.7414 16.7414 k = 0.2659-0.5609-0.0000 ( 4478 PWs) bands (ev): -37.3282 -37.3282 -11.0748 -11.0748 -10.7630 -10.7630 0.1416 0.1416 1.5358 1.5358 1.7588 1.7588 2.1846 2.1846 2.4714 2.4714 3.4487 3.4487 3.7144 3.7144 4.2398 4.2398 5.1773 5.1773 5.6857 5.6857 7.5175 7.5175 15.1506 15.1506 15.6551 15.6551 16.7379 16.7379 k = 0.2616-0.5518 0.0000 ( 4478 PWs) bands (ev): -37.3282 -37.3282 -11.0811 -11.0811 -10.7620 -10.7620 0.1364 0.1364 1.5912 1.5912 1.7811 1.7811 2.1984 2.1984 2.3990 2.3990 3.4811 3.4811 3.6859 3.6859 4.2188 4.2188 5.1681 5.1681 5.7220 5.7220 7.5414 7.5414 15.2025 15.2025 15.5691 15.5691 16.7376 16.7376 k = 0.2573-0.5428-0.0000 ( 4480 PWs) bands (ev): -37.3283 -37.3283 -11.0891 -11.0891 -10.7612 -10.7612 0.1354 0.1354 1.6435 1.6435 1.8081 1.8081 2.2062 2.2062 2.3293 2.3293 3.5119 3.5119 3.6603 3.6603 4.1996 4.1996 5.1602 5.1602 5.7566 5.7566 7.5631 7.5631 15.2567 15.2567 15.4830 15.4830 16.7405 16.7405 k = 0.2530-0.5337-0.0000 ( 4480 PWs) bands (ev): -37.3284 -37.3284 -11.0987 -11.0987 -10.7606 -10.7606 0.1386 0.1386 1.6893 1.6893 1.8427 1.8427 2.2071 2.2071 2.2637 2.2637 3.5400 3.5400 3.6384 3.6384 4.1825 4.1825 5.1536 5.1536 5.7895 5.7895 7.5825 7.5825 15.3132 15.3132 15.3969 15.3969 16.7464 16.7464 k = 0.2487-0.5247-0.0000 ( 4484 PWs) bands (ev): -37.3285 -37.3285 -11.1098 -11.1098 -10.7603 -10.7603 0.1461 0.1461 1.7250 1.7250 1.8875 1.8875 2.1919 2.1919 2.2122 2.2122 3.5625 3.5625 3.6231 3.6231 4.1679 4.1679 5.1483 5.1483 5.8205 5.8205 7.5996 7.5996 15.3088 15.3088 15.3743 15.3743 16.7553 16.7553 k = 0.2444-0.5156 0.0000 ( 4488 PWs) bands (ev): -37.3287 -37.3287 -11.1225 -11.1225 -10.7603 -10.7603 0.1577 0.1577 1.7493 1.7493 1.9419 1.9419 2.1417 2.1417 2.1958 2.1958 3.5695 3.5695 3.6240 3.6240 4.1561 4.1561 5.1445 5.1445 5.8495 5.8495 7.6144 7.6144 15.2229 15.2229 15.4360 15.4360 16.7670 16.7670 k = 0.2401-0.5066 0.0000 ( 4486 PWs) bands (ev): -37.3289 -37.3289 -11.1368 -11.1368 -10.7605 -10.7605 0.1735 0.1735 1.7623 1.7623 2.0007 2.0007 2.0976 2.0976 2.1784 2.1784 3.5597 3.5597 3.6420 3.6420 4.1472 4.1472 5.1423 5.1423 5.8765 5.8765 7.6268 7.6268 15.1366 15.1366 15.5011 15.5011 16.7815 16.7815 k = 0.2358-0.4975 0.0000 ( 4490 PWs) bands (ev): -37.3291 -37.3291 -11.1525 -11.1525 -10.7610 -10.7610 0.1934 0.1934 1.7632 1.7632 2.0326 2.0326 2.0961 2.0961 2.1560 2.1560 3.5443 3.5443 3.6654 3.6654 4.1415 4.1415 5.1417 5.1417 5.9014 5.9014 7.6368 7.6368 15.0503 15.0503 15.5691 15.5691 16.7987 16.7987 k = 0.2316-0.4885-0.0000 ( 4492 PWs) bands (ev): -37.3294 -37.3294 -11.1698 -11.1698 -10.7617 -10.7617 0.2172 0.2172 1.7501 1.7501 2.0192 2.0192 2.1261 2.1261 2.1604 2.1604 3.5274 3.5274 3.6897 3.6897 4.1389 4.1389 5.1427 5.1427 5.9240 5.9240 7.6445 7.6445 14.9643 14.9643 15.6400 15.6400 16.8185 16.8185 k = 0.2273-0.4794-0.0000 ( 4492 PWs) bands (ev): -37.3297 -37.3297 -11.1884 -11.1884 -10.7627 -10.7627 0.2449 0.2449 1.7235 1.7235 2.0108 2.0108 2.0953 2.0953 2.2334 2.2334 3.5093 3.5093 3.7141 3.7141 4.1393 4.1393 5.1456 5.1456 5.9443 5.9443 7.6498 7.6498 14.8784 14.8784 15.7138 15.7138 16.8408 16.8408 k = 0.2230-0.4704-0.0000 ( 4494 PWs) bands (ev): -37.3301 -37.3301 -11.2084 -11.2084 -10.7639 -10.7639 0.2765 0.2765 1.6867 1.6867 2.0093 2.0093 2.0629 2.0629 2.3113 2.3113 3.4901 3.4901 3.7384 3.7384 4.1425 4.1425 5.1503 5.1503 5.9624 5.9624 7.6527 7.6527 14.7928 14.7928 15.7903 15.7903 16.8656 16.8656 k = 0.2187-0.4613-0.0000 ( 4504 PWs) bands (ev): -37.3304 -37.3304 -11.2297 -11.2297 -10.7653 -10.7653 0.3117 0.3117 1.6439 1.6439 1.9965 1.9965 2.0458 2.0458 2.3920 2.3920 3.4696 3.4696 3.7624 3.7624 4.1482 4.1482 5.1568 5.1568 5.9780 5.9780 7.6534 7.6534 14.7074 14.7074 15.8694 15.8694 16.8927 16.8927 k = 0.2144-0.4523 0.0000 ( 4504 PWs) bands (ev): -37.3308 -37.3308 -11.2522 -11.2522 -10.7670 -10.7670 0.3504 0.3504 1.5981 1.5981 1.9595 1.9595 2.0546 2.0546 2.4748 2.4748 3.4477 3.4477 3.7861 3.7861 4.1560 4.1560 5.1654 5.1654 5.9912 5.9912 7.6519 7.6519 14.6223 14.6223 15.9509 15.9509 16.9221 16.9221 k = 0.2101-0.4433-0.0000 ( 4506 PWs) bands (ev): -37.3313 -37.3313 -11.2760 -11.2760 -10.7690 -10.7690 0.3924 0.3924 1.5513 1.5513 1.9141 1.9141 2.0726 2.0726 2.5594 2.5594 3.4245 3.4245 3.8092 3.8092 4.1657 4.1657 5.1759 5.1759 6.0020 6.0020 7.6483 7.6483 14.5374 14.5374 16.0343 16.0343 16.9537 16.9537 k = 0.2058-0.4342 0.0000 ( 4508 PWs) bands (ev): -37.3317 -37.3317 -11.3008 -11.3008 -10.7711 -10.7711 0.4376 0.4376 1.5046 1.5046 1.8653 1.8653 2.0943 2.0943 2.6457 2.6457 3.4000 3.4000 3.8317 3.8317 4.1768 4.1768 5.1885 5.1885 6.0103 6.0103 7.6426 7.6426 14.4528 14.4528 16.1190 16.1190 16.9874 16.9874 k = 0.2015-0.4252 0.0000 ( 4510 PWs) bands (ev): -37.3322 -37.3322 -11.3267 -11.3267 -10.7735 -10.7735 0.4856 0.4856 1.4587 1.4587 1.8146 1.8146 2.1183 2.1183 2.7335 2.7335 3.3744 3.3744 3.8532 3.8532 4.1891 4.1891 5.2030 5.2030 6.0162 6.0162 7.6350 7.6350 14.3684 14.3684 16.2042 16.2042 17.0231 17.0231 k = 0.1972-0.4161-0.0000 ( 4502 PWs) bands (ev): -37.3328 -37.3328 -11.3535 -11.3535 -10.7760 -10.7760 0.5361 0.5361 1.4139 1.4139 1.7627 1.7627 2.1440 2.1440 2.8225 2.8225 3.3478 3.3478 3.8735 3.8735 4.2026 4.2026 5.2195 5.2195 6.0196 6.0196 7.6256 7.6256 14.2842 14.2842 16.2885 16.2885 17.0606 17.0606 k = 0.1930-0.4071 0.0000 ( 4492 PWs) bands (ev): -37.3333 -37.3333 -11.3812 -11.3812 -10.7788 -10.7788 0.5886 0.5886 1.3707 1.3707 1.7105 1.7105 2.1710 2.1710 2.9125 2.9125 3.3206 3.3206 3.8924 3.8924 4.2169 4.2169 5.2378 5.2378 6.0206 6.0206 7.6144 7.6144 14.2002 14.2002 16.3699 16.3699 17.1000 17.1000 k = 0.1887-0.3980 0.0000 ( 4492 PWs) bands (ev): -37.3339 -37.3339 -11.4098 -11.4098 -10.7818 -10.7818 0.6427 0.6427 1.3291 1.3291 1.6587 1.6587 2.1992 2.1992 3.0032 3.0032 3.2930 3.2930 3.9097 3.9097 4.2321 4.2321 5.2580 5.2580 6.0191 6.0191 7.6017 7.6017 14.1164 14.1164 16.4454 16.4454 17.1410 17.1410 k = 0.1844-0.3890-0.0000 ( 4490 PWs) bands (ev): -37.3344 -37.3344 -11.4390 -11.4390 -10.7849 -10.7849 0.6974 0.6974 1.2893 1.2893 1.6083 1.6083 2.2284 2.2284 3.0936 3.0936 3.2659 3.2659 3.9252 3.9252 4.2480 4.2480 5.2798 5.2798 6.0153 6.0153 7.5875 7.5875 14.0327 14.0327 16.5108 16.5108 17.1836 17.1836 k = 0.1801-0.3799 0.0000 ( 4494 PWs) bands (ev): -37.3351 -37.3351 -11.4689 -11.4689 -10.7882 -10.7882 0.7515 0.7515 1.2514 1.2514 1.5606 1.5606 2.2585 2.2585 3.1770 3.1770 3.2463 3.2463 3.9388 3.9388 4.2646 4.2646 5.3033 5.3033 6.0091 6.0091 7.5721 7.5721 13.9492 13.9492 16.5607 16.5607 17.2276 17.2276 k = 0.1758-0.3709 0.0000 ( 4494 PWs) bands (ev): -37.3357 -37.3357 -11.4993 -11.4993 -10.7917 -10.7917 0.8032 0.8032 1.2157 1.2157 1.5174 1.5174 2.2895 2.2895 3.1935 3.1935 3.2937 3.2937 3.9505 3.9505 4.2819 4.2819 5.3281 5.3281 6.0006 6.0006 7.5555 7.5555 13.8658 13.8658 16.5889 16.5889 17.2730 17.2730 k = 0.1715-0.3618 0.0000 ( 4494 PWs) bands (ev): -37.3364 -37.3364 -11.5302 -11.5302 -10.7953 -10.7953 0.8497 0.8497 1.1823 1.1823 1.4814 1.4814 2.3213 2.3213 3.1685 3.1685 3.3828 3.3828 3.9602 3.9602 4.2996 4.2996 5.3543 5.3543 5.9899 5.9899 7.5381 7.5381 13.7825 13.7825 16.5913 16.5913 17.3196 17.3196 k = 0.1672-0.3528-0.0000 ( 4490 PWs) bands (ev): -37.3370 -37.3370 -11.5616 -11.5616 -10.7991 -10.7991 0.8871 0.8871 1.1512 1.1512 1.4564 1.4564 2.3538 2.3538 3.1399 3.1399 3.4757 3.4757 3.9681 3.9681 4.3177 4.3177 5.3816 5.3816 5.9770 5.9770 7.5200 7.5200 13.6993 13.6993 16.5680 16.5680 17.3674 17.3674 k = 0.1629-0.3437 0.0000 ( 4488 PWs) bands (ev): -37.3377 -37.3377 -11.5932 -11.5932 -10.8030 -10.8030 0.9110 0.9110 1.1224 1.1224 1.4470 1.4470 2.3869 2.3869 3.1106 3.1106 3.5692 3.5692 3.9743 3.9743 4.3362 4.3362 5.4098 5.4098 5.9620 5.9620 7.5014 7.5014 13.6161 13.6161 16.5227 16.5227 17.4162 17.4162 k = 0.1587-0.3347-0.0000 ( 4498 PWs) bands (ev): -37.3384 -37.3384 -11.6250 -11.6250 -10.8071 -10.8071 0.9179 0.9179 1.0953 1.0953 1.4571 1.4571 2.4208 2.4208 3.0812 3.0812 3.6626 3.6626 3.9789 3.9789 4.3548 4.3548 5.4389 5.4389 5.9450 5.9450 7.4825 7.4825 13.5330 13.5330 16.4608 16.4608 17.4659 17.4659 k = 0.1544-0.3257 0.0000 ( 4504 PWs) bands (ev): -37.3391 -37.3391 -11.6570 -11.6570 -10.8112 -10.8112 0.9083 0.9083 1.0691 1.0691 1.4872 1.4872 2.4552 2.4552 3.0519 3.0519 3.7556 3.7556 3.9822 3.9822 4.3735 4.3735 5.4685 5.4685 5.9260 5.9260 7.4636 7.4636 13.4501 13.4501 16.3876 16.3876 17.5164 17.5164 k = 0.1501-0.3166-0.0000 ( 4502 PWs) bands (ev): -37.3398 -37.3398 -11.6891 -11.6891 -10.8154 -10.8154 0.8854 0.8854 1.0435 1.0435 1.5340 1.5340 2.4901 2.4901 3.0229 3.0229 3.8476 3.8476 3.9846 3.9846 4.3922 4.3922 5.4987 5.4987 5.9052 5.9052 7.4449 7.4449 13.3671 13.3671 16.3066 16.3066 17.5676 17.5676 k = 0.1458-0.3076-0.0000 ( 4505 PWs) bands (ev): -37.3406 -37.3406 -11.7212 -11.7212 -10.8198 -10.8198 0.8531 0.8531 1.0187 1.0187 1.5934 1.5934 2.5255 2.5255 2.9943 2.9943 3.9363 3.9363 3.9881 3.9881 4.4108 4.4108 5.5292 5.5292 5.8826 5.8826 7.4268 7.4268 13.2843 13.2843 16.2208 16.2208 17.6193 17.6193 k = 0.1415-0.2985 0.0000 ( 4499 PWs) bands (ev): -37.3413 -37.3413 -11.7531 -11.7531 -10.8241 -10.8241 0.8145 0.8145 0.9954 0.9954 1.6616 1.6616 2.5612 2.5612 2.9663 2.9663 3.9795 3.9795 4.0348 4.0348 4.4293 4.4293 5.5598 5.5598 5.8584 5.8584 7.4094 7.4094 13.2015 13.2015 16.1318 16.1318 17.6713 17.6713 k = 0.1372-0.2895-0.0000 ( 4501 PWs) bands (ev): -37.3421 -37.3421 -11.7850 -11.7850 -10.8286 -10.8286 0.7719 0.7719 0.9738 0.9738 1.7359 1.7359 2.5971 2.5971 2.9391 2.9391 3.9812 3.9812 4.1207 4.1207 4.4476 4.4476 5.5904 5.5904 5.8328 5.8328 7.3932 7.3932 13.1189 13.1189 16.0409 16.0409 17.7236 17.7236 k = 0.1329-0.2804-0.0000 ( 4505 PWs) bands (ev): -37.3428 -37.3428 -11.8166 -11.8166 -10.8331 -10.8331 0.7267 0.7267 0.9540 0.9540 1.8145 1.8145 2.6328 2.6328 2.9130 2.9130 3.9804 3.9804 4.2062 4.2062 4.4658 4.4658 5.6208 5.6208 5.8059 5.8059 7.3784 7.3784 13.0364 13.0364 15.9491 15.9491 17.7760 17.7760 k = 0.1286-0.2714 0.0000 ( 4501 PWs) bands (ev): -37.3435 -37.3435 -11.8478 -11.8478 -10.8376 -10.8376 0.6801 0.6801 0.9360 0.9360 1.8960 1.8960 2.6678 2.6678 2.8887 2.8887 3.9788 3.9788 4.2892 4.2892 4.4842 4.4842 5.6504 5.6504 5.7781 5.7781 7.3653 7.3653 12.9541 12.9541 15.8570 15.8570 17.8283 17.8283 k = 0.1244-0.2623-0.0000 ( 4497 PWs) bands (ev): -37.3443 -37.3443 -11.8787 -11.8787 -10.8421 -10.8421 0.6329 0.6329 0.9197 0.9197 1.9795 1.9795 2.7008 2.7008 2.8676 2.8676 3.9769 3.9769 4.3683 4.3683 4.5035 4.5035 5.6781 5.6781 5.7508 5.7508 7.3544 7.3544 12.8720 12.8720 15.7650 15.7650 17.8804 17.8804 k = 0.1201-0.2533 0.0000 ( 4497 PWs) bands (ev): -37.3450 -37.3450 -11.9092 -11.9092 -10.8467 -10.8467 0.5855 0.5855 0.9050 0.9050 2.0642 2.0642 2.7283 2.7283 2.8529 2.8529 3.9749 3.9749 4.4402 4.4402 4.5263 4.5263 5.6941 5.6941 5.7337 5.7337 7.3458 7.3458 12.7902 12.7902 15.6735 15.6735 17.9323 17.9323 k = 0.1158-0.2442-0.0000 ( 4495 PWs) bands (ev): -37.3458 -37.3458 -11.9392 -11.9392 -10.8512 -10.8512 0.5385 0.5385 0.8919 0.8919 2.1495 2.1495 2.7435 2.7435 2.8519 2.8519 3.9730 3.9730 4.4954 4.4954 4.5620 4.5620 5.6759 5.6759 5.7494 5.7494 7.3401 7.3401 12.7088 12.7088 15.5827 15.5827 17.9837 17.9837 k = 0.1115-0.2352-0.0000 ( 4491 PWs) bands (ev): -37.3465 -37.3465 -11.9686 -11.9686 -10.8557 -10.8557 0.4920 0.4920 0.8803 0.8803 2.2348 2.2348 2.7414 2.7414 2.8693 2.8693 3.9713 3.9713 4.5266 4.5266 4.6173 4.6173 5.6456 5.6456 5.7756 5.7756 7.3374 7.3374 12.6278 12.6278 15.4928 15.4928 18.0344 18.0344 k = 0.1072-0.2261 0.0000 ( 4497 PWs) bands (ev): -37.3472 -37.3472 -11.9974 -11.9974 -10.8602 -10.8602 0.4464 0.4464 0.8701 0.8701 2.3193 2.3193 2.7288 2.7288 2.8990 2.8990 3.9700 3.9700 4.5466 4.5466 4.6791 4.6791 5.6130 5.6130 5.8030 5.8030 7.3382 7.3382 12.5473 12.5473 15.4042 15.4042 18.0845 18.0845 k = 0.1029-0.2171 0.0000 ( 4495 PWs) bands (ev): -37.3479 -37.3479 -12.0255 -12.0255 -10.8646 -10.8646 0.4019 0.4019 0.8612 0.8612 2.4020 2.4020 2.7129 2.7129 2.9341 2.9341 3.9693 3.9693 4.5630 4.5630 4.7392 4.7392 5.5793 5.5793 5.8300 5.8300 7.3426 7.3426 12.4675 12.4675 15.3168 15.3168 18.1337 18.1337 k = 0.0986-0.2081-0.0000 ( 4491 PWs) bands (ev): -37.3486 -37.3486 -12.0528 -12.0528 -10.8690 -10.8690 0.3585 0.3585 0.8535 0.8535 2.4808 2.4808 2.6983 2.6983 2.9716 2.9716 3.9693 3.9693 4.5779 4.5779 4.7954 4.7954 5.5452 5.5452 5.8565 5.8565 7.3508 7.3508 12.3884 12.3884 15.2309 15.2309 18.1819 18.1819 k = 0.0943-0.1990-0.0000 ( 4491 PWs) bands (ev): -37.3493 -37.3493 -12.0794 -12.0794 -10.8733 -10.8733 0.3164 0.3164 0.8470 0.8470 2.5498 2.5498 2.6916 2.6916 3.0104 3.0104 3.9703 3.9703 4.5917 4.5917 4.8467 4.8467 5.5108 5.5108 5.8823 5.8823 7.3630 7.3630 12.3102 12.3102 15.1466 15.1466 18.2290 18.2290 k = 0.0900-0.1900 0.0000 ( 4485 PWs) bands (ev): -37.3499 -37.3499 -12.1052 -12.1052 -10.8775 -10.8775 0.2757 0.2757 0.8415 0.8415 2.5910 2.5910 2.7109 2.7109 3.0498 3.0498 3.9723 3.9723 4.6049 4.6049 4.8926 4.8926 5.4765 5.4765 5.9072 5.9072 7.3793 7.3793 12.2331 12.2331 15.0640 15.0640 18.2748 18.2748 k = 0.0858-0.1809 0.0000 ( 4487 PWs) bands (ev): -37.3506 -37.3506 -12.1300 -12.1300 -10.8816 -10.8816 0.2365 0.2365 0.8370 0.8370 2.5958 2.5958 2.7646 2.7646 3.0897 3.0897 3.9757 3.9757 4.6176 4.6176 4.9326 4.9326 5.4427 5.4427 5.9312 5.9312 7.3996 7.3996 12.1572 12.1572 14.9833 14.9833 18.3193 18.3193 k = 0.0815-0.1719 0.0000 ( 4489 PWs) bands (ev): -37.3512 -37.3512 -12.1539 -12.1539 -10.8856 -10.8856 0.1988 0.1988 0.8335 0.8335 2.5853 2.5853 2.8312 2.8312 3.1297 3.1297 3.9805 3.9805 4.6297 4.6297 4.9665 4.9665 5.4098 5.4098 5.9543 5.9543 7.4237 7.4237 12.0826 12.0826 14.9047 14.9047 18.3623 18.3623 k = 0.0772-0.1628 0.0000 ( 4481 PWs) bands (ev): -37.3518 -37.3518 -12.1769 -12.1769 -10.8894 -10.8894 0.1628 0.1628 0.8307 0.8307 2.5707 2.5707 2.8992 2.8992 3.1698 3.1698 3.9870 3.9870 4.6415 4.6415 4.9938 4.9938 5.3783 5.3783 5.9763 5.9763 7.4515 7.4515 12.0096 12.0096 14.8282 14.8282 18.4038 18.4038 k = 0.0729-0.1538-0.0000 ( 4477 PWs) bands (ev): -37.3524 -37.3524 -12.1988 -12.1988 -10.8931 -10.8931 0.1284 0.1284 0.8287 0.8287 2.5551 2.5551 2.9650 2.9650 3.2098 3.2098 3.9954 3.9954 4.6529 4.6529 5.0143 5.0143 5.3489 5.3489 5.9972 5.9972 7.4825 7.4825 11.9384 11.9384 14.7540 14.7540 18.4435 18.4435 k = 0.0686-0.1447-0.0000 ( 4479 PWs) bands (ev): -37.3530 -37.3530 -12.2197 -12.2197 -10.8967 -10.8967 0.0958 0.0958 0.8274 0.8274 2.5395 2.5395 3.0272 3.0272 3.2496 3.2496 4.0057 4.0057 4.6641 4.6641 5.0275 5.0275 5.3224 5.3224 6.0171 6.0171 7.5163 7.5163 11.8692 11.8692 14.6824 14.6824 18.4815 18.4815 k = 0.0643-0.1357 0.0000 ( 4479 PWs) bands (ev): -37.3535 -37.3535 -12.2395 -12.2395 -10.9001 -10.9001 0.0650 0.0650 0.8267 0.8267 2.5243 2.5243 3.0850 3.0850 3.2891 3.2891 4.0181 4.0181 4.6749 4.6749 5.0332 5.0332 5.2995 5.2995 6.0358 6.0358 7.5525 7.5525 11.8023 11.8023 14.6134 14.6134 18.5175 18.5175 k = 0.0600-0.1266 0.0000 ( 4489 PWs) bands (ev): -37.3540 -37.3540 -12.2582 -12.2582 -10.9034 -10.9034 0.0360 0.0360 0.8264 0.8264 2.5097 2.5097 3.1379 3.1379 3.3281 3.3281 4.0326 4.0326 4.6855 4.6855 5.0311 5.0311 5.2809 5.2809 6.0534 6.0534 7.5904 7.5904 11.7379 11.7379 14.5474 14.5474 18.5517 18.5517 k = 0.0557-0.1176 0.0000 ( 4485 PWs) bands (ev): -37.3545 -37.3545 -12.2757 -12.2757 -10.9064 -10.9064 0.0088 0.0088 0.8266 0.8266 2.4960 2.4960 3.1855 3.1855 3.3665 3.3665 4.0490 4.0490 4.6959 4.6959 5.0220 5.0220 5.2667 5.2667 6.0698 6.0698 7.6294 7.6294 11.6762 11.6762 14.4844 14.4844 18.5837 18.5837 k = 0.0515-0.1086-0.0000 ( 4495 PWs) bands (ev): -37.3549 -37.3549 -12.2920 -12.2920 -10.9093 -10.9093 -0.0165 -0.0165 0.8272 0.8272 2.4831 2.4831 3.2279 3.2279 3.4039 3.4039 4.0671 4.0671 4.7061 4.7061 5.0069 5.0069 5.2563 5.2563 6.0850 6.0850 7.6689 7.6689 11.6175 11.6175 14.4248 14.4248 18.6137 18.6137 k = 0.0472-0.0995-0.0000 ( 4487 PWs) bands (ev): -37.3554 -37.3554 -12.3071 -12.3071 -10.9120 -10.9120 -0.0398 -0.0398 0.8280 0.8280 2.4711 2.4711 3.2650 3.2650 3.4403 3.4403 4.0866 4.0866 4.7161 4.7161 4.9875 4.9875 5.2487 5.2487 6.0990 6.0990 7.7083 7.7083 11.5622 11.5622 14.3687 14.3687 18.6415 18.6415 k = 0.0429-0.0905 0.0000 ( 4483 PWs) bands (ev): -37.3557 -37.3557 -12.3210 -12.3210 -10.9145 -10.9145 -0.0612 -0.0612 0.8290 0.8290 2.4600 2.4600 3.2970 3.2970 3.4751 3.4751 4.1069 4.1069 4.7258 4.7258 4.9652 4.9652 5.2430 5.2430 6.1118 6.1118 7.7468 7.7468 11.5104 11.5104 14.3164 14.3164 18.6671 18.6671 k = 0.0386-0.0814 0.0000 ( 4481 PWs) bands (ev): -37.3561 -37.3561 -12.3337 -12.3337 -10.9167 -10.9167 -0.0806 -0.0806 0.8301 0.8301 2.4499 2.4499 3.3244 3.3244 3.5082 3.5082 4.1275 4.1275 4.7351 4.7351 4.9417 4.9417 5.2384 5.2384 6.1234 6.1234 7.7838 7.7838 11.4626 11.4626 14.2681 14.2681 18.6904 18.6904 k = 0.0343-0.0724-0.0000 ( 4473 PWs) bands (ev): -37.3564 -37.3564 -12.3450 -12.3450 -10.9188 -10.9188 -0.0980 -0.0980 0.8313 0.8313 2.4409 2.4409 3.3475 3.3475 3.5393 3.5393 4.1479 4.1479 4.7441 4.7441 4.9179 4.9179 5.2346 5.2346 6.1337 6.1337 7.8188 7.8188 11.4188 11.4188 14.2241 14.2241 18.7113 18.7113 k = 0.0300-0.0633 0.0000 ( 4479 PWs) bands (ev): -37.3567 -37.3567 -12.3551 -12.3551 -10.9206 -10.9206 -0.1135 -0.1135 0.8326 0.8326 2.4328 2.4328 3.3668 3.3668 3.5679 3.5679 4.1674 4.1674 4.7525 4.7525 4.8948 4.8948 5.2313 5.2313 6.1429 6.1429 7.8511 7.8511 11.3795 11.3795 14.1846 14.1846 18.7299 18.7299 k = 0.0257-0.0543 0.0000 ( 4475 PWs) bands (ev): -37.3569 -37.3569 -12.3638 -12.3638 -10.9222 -10.9222 -0.1269 -0.1269 0.8337 0.8337 2.4258 2.4258 3.3825 3.3825 3.5937 3.5937 4.1854 4.1854 4.7603 4.7603 4.8733 4.8733 5.2283 5.2283 6.1508 6.1508 7.8802 7.8802 11.3449 11.3449 14.1498 14.1498 18.7461 18.7461 k = 0.0214-0.0452 0.0000 ( 4473 PWs) bands (ev): -37.3571 -37.3571 -12.3713 -12.3713 -10.9235 -10.9235 -0.1382 -0.1382 0.8348 0.8348 2.4199 2.4199 3.3952 3.3952 3.6164 3.6164 4.2015 4.2015 4.7671 4.7671 4.8539 4.8539 5.2256 5.2256 6.1574 6.1574 7.9057 7.9057 11.3151 11.3151 14.1200 14.1200 18.7598 18.7598 k = 0.0172-0.0362 0.0000 ( 4477 PWs) bands (ev): -37.3573 -37.3573 -12.3774 -12.3774 -10.9246 -10.9246 -0.1475 -0.1475 0.8357 0.8357 2.4150 2.4150 3.4051 3.4051 3.6356 3.6356 4.2152 4.2152 4.7728 4.7728 4.8373 4.8373 5.2233 5.2233 6.1629 6.1629 7.9272 7.9272 11.2904 11.2904 14.0953 14.0953 18.7711 18.7711 k = 0.0129-0.0271 0.0000 ( 4483 PWs) bands (ev): -37.3574 -37.3574 -12.3821 -12.3821 -10.9255 -10.9255 -0.1548 -0.1548 0.8365 0.8365 2.4112 2.4112 3.4125 3.4125 3.6509 3.6509 4.2262 4.2262 4.7771 4.7771 4.8242 4.8242 5.2215 5.2215 6.1672 6.1672 7.9443 7.9443 11.2711 11.2711 14.0759 14.0759 18.7799 18.7799 k = 0.0086-0.0181 0.0000 ( 4483 PWs) bands (ev): -37.3575 -37.3575 -12.3855 -12.3855 -10.9261 -10.9261 -0.1600 -0.1600 0.8371 0.8371 2.4085 2.4085 3.4177 3.4177 3.6622 3.6622 4.2342 4.2342 4.7798 4.7798 4.8150 4.8150 5.2201 5.2201 6.1702 6.1702 7.9567 7.9567 11.2571 11.2571 14.0619 14.0619 18.7861 18.7861 k = 0.0043-0.0090 0.0000 ( 4485 PWs) bands (ev): -37.3576 -37.3576 -12.3876 -12.3876 -10.9265 -10.9265 -0.1631 -0.1631 0.8374 0.8374 2.4069 2.4069 3.4207 3.4207 3.6690 3.6690 4.2391 4.2391 4.7811 4.7811 4.8097 4.8097 5.2193 5.2193 6.1720 6.1720 7.9642 7.9642 11.2487 11.2487 14.0535 14.0535 18.7899 18.7899 k = 0.0000 0.0000 0.0000 ( 4485 PWs) bands (ev): -37.3576 -37.3576 -12.3882 -12.3882 -10.9266 -10.9266 -0.1641 -0.1641 0.8375 0.8375 2.4063 2.4063 3.4217 3.4217 3.6713 3.6713 4.2407 4.2407 4.7814 4.7814 4.8081 4.8081 5.2190 5.2190 6.1726 6.1726 7.9667 7.9667 11.2459 11.2459 14.0507 14.0507 18.7912 18.7912 k = 0.0000 0.0000 0.0000 ( 4485 PWs) bands (ev): -37.3576 -37.3576 -12.3882 -12.3882 -10.9266 -10.9266 -0.1641 -0.1641 0.8375 0.8375 2.4063 2.4063 3.4217 3.4217 3.6713 3.6713 4.2407 4.2407 4.7814 4.7814 4.8081 4.8081 5.2190 5.2190 6.1726 6.1726 7.9667 7.9667 11.2459 11.2459 14.0507 14.0507 18.7912 18.7912 k = 0.0076-0.0062-0.0025 ( 4486 PWs) bands (ev): -37.3576 -37.3576 -12.3876 -12.3876 -10.9265 -10.9265 -0.1632 -0.1632 0.8374 0.8374 2.4067 2.4067 3.4208 3.4208 3.6695 3.6695 4.2392 4.2392 4.7811 4.7811 4.8094 4.8094 5.2190 5.2190 6.1719 6.1719 7.9647 7.9647 11.2486 11.2486 14.0536 14.0536 18.7896 18.7896 k = 0.0152-0.0124-0.0050 ( 4485 PWs) bands (ev): -37.3575 -37.3575 -12.3858 -12.3858 -10.9262 -10.9262 -0.1604 -0.1604 0.8372 0.8372 2.4077 2.4077 3.4179 3.4179 3.6642 3.6642 4.2346 4.2346 4.7800 4.7800 4.8138 4.8138 5.2190 5.2190 6.1696 6.1696 7.9589 7.9589 11.2568 11.2568 14.0622 14.0622 18.7847 18.7847 k = 0.0227-0.0186-0.0075 ( 4481 PWs) bands (ev): -37.3575 -37.3575 -12.3827 -12.3827 -10.9257 -10.9257 -0.1558 -0.1558 0.8367 0.8367 2.4094 2.4094 3.4131 3.4131 3.6555 3.6555 4.2271 4.2271 4.7777 4.7777 4.8214 4.8214 5.2191 5.2191 6.1658 6.1658 7.9492 7.9492 11.2703 11.2703 14.0765 14.0765 18.7767 18.7767 k = 0.0303-0.0248-0.0099 ( 4479 PWs) bands (ev): -37.3573 -37.3573 -12.3784 -12.3784 -10.9251 -10.9251 -0.1494 -0.1494 0.8361 0.8361 2.4117 2.4117 3.4063 3.4063 3.6435 3.6435 4.2169 4.2169 4.7738 4.7738 4.8324 4.8324 5.2193 5.2193 6.1606 6.1606 7.9359 7.9359 11.2891 11.2891 14.0964 14.0964 18.7656 18.7656 k = 0.0379-0.0310-0.0124 ( 4482 PWs) bands (ev): -37.3572 -37.3572 -12.3729 -12.3729 -10.9242 -10.9242 -0.1412 -0.1412 0.8353 0.8353 2.4147 2.4147 3.3973 3.3973 3.6284 3.6284 4.2041 4.2041 4.7684 4.7684 4.8463 4.8463 5.2196 5.2196 6.1539 6.1539 7.9190 7.9190 11.3130 11.3130 14.1219 14.1219 18.7515 18.7515 k = 0.0455-0.0372-0.0149 ( 4484 PWs) bands (ev): -37.3570 -37.3570 -12.3662 -12.3662 -10.9232 -10.9232 -0.1311 -0.1311 0.8345 0.8345 2.4183 2.4183 3.3861 3.3861 3.6103 3.6103 4.1890 4.1890 4.7619 4.7619 4.8627 4.8627 5.2202 5.2202 6.1457 6.1457 7.8988 7.8988 11.3419 11.3419 14.1526 14.1526 18.7344 18.7344 k = 0.0530-0.0434-0.0174 ( 4485 PWs) bands (ev): -37.3568 -37.3568 -12.3583 -12.3583 -10.9219 -10.9219 -0.1193 -0.1193 0.8335 0.8335 2.4225 2.4225 3.3724 3.3724 3.5895 3.5895 4.1721 4.1721 4.7542 4.7542 4.8811 4.8811 5.2211 5.2211 6.1361 6.1361 7.8755 7.8755 11.3755 11.3755 14.1886 14.1886 18.7145 18.7145 k = 0.0606-0.0496-0.0199 ( 4482 PWs) bands (ev): -37.3566 -37.3566 -12.3492 -12.3492 -10.9205 -10.9205 -0.1057 -0.1057 0.8325 0.8325 2.4273 2.4273 3.3561 3.3561 3.5660 3.5660 4.1536 4.1536 4.7457 4.7457 4.9008 4.9008 5.2224 5.2224 6.1251 6.1251 7.8494 7.8494 11.4135 11.4135 14.2297 14.2297 18.6920 18.6920 k = 0.0682-0.0558-0.0224 ( 4478 PWs) bands (ev): -37.3563 -37.3563 -12.3389 -12.3389 -10.9189 -10.9189 -0.0904 -0.0904 0.8314 0.8314 2.4326 2.4326 3.3372 3.3372 3.5399 3.5399 4.1341 4.1341 4.7364 4.7364 4.9214 4.9214 5.2243 5.2243 6.1128 6.1128 7.8208 7.8208 11.4559 11.4559 14.2755 14.2755 18.6670 18.6670 k = 0.0758-0.0620-0.0248 ( 4483 PWs) bands (ev): -37.3560 -37.3560 -12.3275 -12.3275 -10.9171 -10.9171 -0.0734 -0.0734 0.8304 0.8304 2.4385 2.4385 3.3154 3.3154 3.5113 3.5113 4.1141 4.1141 4.7266 4.7266 4.9421 4.9421 5.2269 5.2269 6.0991 6.0991 7.7902 7.7902 11.5022 11.5022 14.3259 14.3259 18.6397 18.6397 k = 0.0833-0.0681-0.0273 ( 4487 PWs) bands (ev): -37.3557 -37.3557 -12.3149 -12.3149 -10.9152 -10.9152 -0.0547 -0.0547 0.8295 0.8295 2.4448 2.4448 3.2907 3.2907 3.4800 3.4800 4.0941 4.0941 4.7163 4.7163 4.9622 4.9622 5.2305 5.2305 6.0841 6.0841 7.7577 7.7577 11.5521 11.5521 14.3807 14.3807 18.6101 18.6101 k = 0.0909-0.0743-0.0298 ( 4486 PWs) bands (ev): -37.3553 -37.3553 -12.3011 -12.3011 -10.9131 -10.9131 -0.0344 -0.0344 0.8287 0.8287 2.4516 2.4516 3.2629 3.2629 3.4463 3.4463 4.0746 4.0746 4.7057 4.7057 4.9808 4.9808 5.2357 5.2357 6.0679 6.0679 7.7239 7.7239 11.6054 11.6054 14.4396 14.4396 18.5786 18.5786 k = 0.0985-0.0805-0.0323 ( 4489 PWs) bands (ev): -37.3549 -37.3549 -12.2863 -12.2863 -10.9108 -10.9108 -0.0124 -0.0124 0.8282 0.8282 2.4587 2.4587 3.2319 3.2319 3.4102 3.4102 4.0561 4.0561 4.6950 4.6950 4.9970 4.9970 5.2428 5.2428 6.0505 6.0505 7.6891 7.6891 11.6618 11.6618 14.5025 14.5025 18.5453 18.5453 k = 0.1061-0.0867-0.0348 ( 4488 PWs) bands (ev): -37.3545 -37.3545 -12.2704 -12.2704 -10.9084 -10.9084 0.0110 0.0110 0.8279 0.8279 2.4660 2.4660 3.1974 3.1974 3.3721 3.3721 4.0391 4.0391 4.6841 4.6841 5.0097 5.0097 5.2526 5.2526 6.0319 6.0319 7.6537 7.6537 11.7208 11.7208 14.5690 14.5690 18.5103 18.5103 k = 0.1136-0.0929-0.0373 ( 4490 PWs) bands (ev): -37.3541 -37.3541 -12.2534 -12.2534 -10.9058 -10.9058 0.0359 0.0359 0.8279 0.8279 2.4736 2.4736 3.1591 3.1591 3.3325 3.3325 4.0238 4.0238 4.6732 4.6732 5.0179 5.0179 5.2655 5.2655 6.0123 6.0123 7.6181 7.6181 11.7822 11.7822 14.6389 14.6389 18.4739 18.4739 k = 0.1212-0.0991-0.0397 ( 4493 PWs) bands (ev): -37.3536 -37.3536 -12.2354 -12.2354 -10.9030 -10.9030 0.0622 0.0622 0.8285 0.8285 2.4811 2.4811 3.1163 3.1163 3.2922 3.2922 4.0104 4.0104 4.6622 4.6622 5.0210 5.0210 5.2818 5.2818 5.9917 5.9917 7.5829 7.5829 11.8457 11.8457 14.7120 14.7120 18.4362 18.4362 k = 0.1288-0.1053-0.0422 ( 4494 PWs) bands (ev): -37.3531 -37.3531 -12.2164 -12.2164 -10.9001 -10.9001 0.0898 0.0898 0.8295 0.8295 2.4886 2.4886 3.0688 3.0688 3.2522 3.2522 3.9991 3.9991 4.6513 4.6513 5.0187 5.0187 5.3013 5.3013 5.9701 5.9701 7.5482 7.5482 11.9109 11.9109 14.7880 14.7880 18.3974 18.3974 k = 0.1364-0.1115-0.0447 ( 4492 PWs) bands (ev): -37.3526 -37.3526 -12.1964 -12.1964 -10.8971 -10.8971 0.1187 0.1187 0.8312 0.8312 2.4958 2.4958 3.0161 3.0161 3.2133 3.2133 3.9899 3.9899 4.6404 4.6404 5.0111 5.0111 5.3237 5.3237 5.9476 5.9476 7.5146 7.5146 11.9775 11.9775 14.8667 14.8667 18.3578 18.3578 k = 0.1439-0.1177-0.0472 ( 4495 PWs) bands (ev): -37.3521 -37.3521 -12.1754 -12.1754 -10.8940 -10.8940 0.1486 0.1486 0.8336 0.8336 2.5024 2.5024 2.9584 2.9584 3.1761 3.1761 3.9826 3.9826 4.6295 4.6295 4.9983 4.9983 5.3484 5.3484 5.9243 5.9243 7.4824 7.4824 12.0451 12.0451 14.9478 14.9478 18.3173 18.3173 k = 0.1515-0.1239-0.0497 ( 4494 PWs) bands (ev): -37.3515 -37.3515 -12.1536 -12.1536 -10.8907 -10.8907 0.1796 0.1796 0.8370 0.8370 2.5081 2.5081 2.8961 2.8961 3.1411 3.1411 3.9772 3.9772 4.6186 4.6186 4.9807 4.9807 5.3749 5.3749 5.9001 5.9001 7.4520 7.4520 12.1134 12.1134 15.0311 15.0311 18.2763 18.2763 k = 0.1591-0.1301-0.0522 ( 4495 PWs) bands (ev): -37.3509 -37.3509 -12.1308 -12.1308 -10.8873 -10.8873 0.2115 0.2115 0.8413 0.8413 2.5124 2.5124 2.8297 2.8297 3.1086 3.1086 3.9735 3.9735 4.6075 4.6075 4.9584 4.9584 5.4028 5.4028 5.8752 5.8752 7.4235 7.4235 12.1821 12.1821 15.1163 15.1163 18.2350 18.2350 k = 0.1667-0.1363-0.0546 ( 4490 PWs) bands (ev): -37.3503 -37.3503 -12.1072 -12.1072 -10.8838 -10.8838 0.2440 0.2440 0.8469 0.8469 2.5146 2.5146 2.7603 2.7603 3.0788 3.0788 3.9715 3.9715 4.5964 4.5964 4.9319 4.9319 5.4315 5.4315 5.8496 5.8496 7.3974 7.3974 12.2509 12.2509 15.2033 15.2033 18.1934 18.1934 k = 0.1742-0.1425-0.0571 ( 4494 PWs) bands (ev): -37.3497 -37.3497 -12.0828 -12.0828 -10.8802 -10.8802 0.2771 0.2771 0.8538 0.8538 2.5132 2.5132 2.6897 2.6897 3.0519 3.0519 3.9708 3.9708 4.5850 4.5850 4.9012 4.9012 5.4608 5.4608 5.8233 5.8233 7.3737 7.3737 12.3195 12.3195 15.2916 15.2916 18.1518 18.1518 k = 0.1818-0.1487-0.0596 ( 4494 PWs) bands (ev): -37.3491 -37.3491 -12.0576 -12.0576 -10.8765 -10.8765 0.3105 0.3105 0.8623 0.8623 2.5039 2.5039 2.6221 2.6221 3.0283 3.0283 3.9714 3.9714 4.5733 4.5733 4.8667 4.8667 5.4904 5.4904 5.7963 5.7963 7.3526 7.3526 12.3874 12.3874 15.3812 15.3812 18.1102 18.1102 k = 0.1894-0.1549-0.0621 ( 4491 PWs) bands (ev): -37.3485 -37.3485 -12.0317 -12.0317 -10.8727 -10.8727 0.3439 0.3439 0.8725 0.8725 2.4746 2.4746 2.5699 2.5699 3.0084 3.0084 3.9731 3.9731 4.5611 4.5611 4.8286 4.8286 5.5200 5.5200 5.7689 5.7689 7.3344 7.3344 12.4546 12.4546 15.4716 15.4716 18.0690 18.0690 k = 0.1970-0.1611-0.0646 ( 4492 PWs) bands (ev): -37.3478 -37.3478 -12.0051 -12.0051 -10.8689 -10.8689 0.3772 0.3772 0.8847 0.8847 2.4153 2.4153 2.5430 2.5430 2.9923 2.9923 3.9758 3.9758 4.5482 4.5482 4.7875 4.7875 5.5495 5.5495 5.7410 5.7410 7.3189 7.3189 12.5205 12.5205 15.5627 15.5627 18.0282 18.0282 k = 0.2045-0.1673-0.0671 ( 4495 PWs) bands (ev): -37.3472 -37.3472 -11.9779 -11.9779 -10.8650 -10.8650 0.4101 0.4101 0.8991 0.8991 2.3404 2.3404 2.5274 2.5274 2.9804 2.9804 3.9792 3.9792 4.5341 4.5341 4.7438 4.7438 5.5782 5.5782 5.7131 5.7131 7.3062 7.3062 12.5850 12.5850 15.6540 15.6540 17.9881 17.9881 k = 0.2121-0.1735-0.0695 ( 4493 PWs) bands (ev): -37.3465 -37.3465 -11.9501 -11.9501 -10.8610 -10.8610 0.4423 0.4423 0.9160 0.9160 2.2601 2.2601 2.5130 2.5130 2.9728 2.9728 3.9832 3.9832 4.5183 4.5183 4.6986 4.6986 5.6049 5.6049 5.6864 5.6864 7.2963 7.2963 12.6477 12.6477 15.7452 15.7452 17.9487 17.9487 k = 0.2197-0.1797-0.0720 ( 4493 PWs) bands (ev): -37.3458 -37.3458 -11.9218 -11.9218 -10.8569 -10.8569 0.4736 0.4736 0.9354 0.9354 2.1776 2.1776 2.4973 2.4973 2.9692 2.9692 3.9876 3.9876 4.4995 4.4995 4.6532 4.6532 5.6217 5.6217 5.6688 5.6688 7.2891 7.2891 12.7083 12.7083 15.8359 15.8359 17.9104 17.9104 k = 0.2273-0.1859-0.0745 ( 4493 PWs) bands (ev): -37.3451 -37.3451 -11.8929 -11.8929 -10.8529 -10.8529 0.5036 0.5036 0.9574 0.9574 2.0942 2.0942 2.4795 2.4795 2.9696 2.9696 3.9921 3.9921 4.4757 4.4757 4.6101 4.6101 5.6090 5.6090 5.6798 5.6798 7.2845 7.2845 12.7667 12.7667 15.9256 15.9256 17.8734 17.8734 k = 0.2348-0.1921-0.0770 ( 4491 PWs) bands (ev): -37.3444 -37.3444 -11.8637 -11.8637 -10.8488 -10.8488 0.5323 0.5323 0.9822 0.9822 2.0106 2.0106 2.4597 2.4597 2.9735 2.9735 3.9964 3.9964 4.4444 4.4444 4.5723 4.5723 5.5817 5.5817 5.7044 5.7044 7.2823 7.2823 12.8224 12.8224 16.0139 16.0139 17.8379 17.8379 k = 0.2424-0.1982-0.0795 ( 4491 PWs) bands (ev): -37.3437 -37.3437 -11.8341 -11.8341 -10.8446 -10.8446 0.5596 0.5596 1.0094 1.0094 1.9275 1.9275 2.4381 2.4381 2.9805 2.9805 4.0001 4.0001 4.4041 4.4041 4.5418 4.5418 5.5514 5.5514 5.7312 5.7312 7.2824 7.2824 12.8754 12.8754 16.0999 16.0999 17.8043 17.8043 k = 0.2500-0.2044-0.0820 ( 4490 PWs) bands (ev): -37.3430 -37.3430 -11.8042 -11.8042 -10.8405 -10.8405 0.5855 0.5855 1.0387 1.0387 1.8457 1.8457 2.4150 2.4150 2.9901 2.9901 4.0024 4.0024 4.3566 4.3566 4.5178 4.5178 5.5199 5.5199 5.7582 5.7582 7.2847 7.2847 12.9254 12.9254 16.1829 16.1829 17.7733 17.7733 k = 0.2576-0.2106-0.0844 ( 4486 PWs) bands (ev): -37.3423 -37.3423 -11.7741 -11.7741 -10.8364 -10.8364 0.6099 0.6099 1.0695 1.0695 1.7659 1.7659 2.3909 2.3909 3.0021 3.0021 4.0021 4.0021 4.3055 4.3055 4.4980 4.4980 5.4878 5.4878 5.7850 5.7850 7.2888 7.2888 12.9721 12.9721 16.2620 16.2620 17.7453 17.7453 k = 0.2652-0.2168-0.0869 ( 4489 PWs) bands (ev): -37.3417 -37.3417 -11.7437 -11.7437 -10.8322 -10.8322 0.6331 0.6331 1.1005 1.1005 1.6894 1.6894 2.3659 2.3659 3.0160 3.0160 3.9971 3.9971 4.2547 4.2547 4.4807 4.4807 5.4553 5.4553 5.8113 5.8113 7.2947 7.2947 13.0154 13.0154 16.3359 16.3359 17.7213 17.7213 k = 0.2727-0.2230-0.0894 ( 4488 PWs) bands (ev): -37.3410 -37.3410 -11.7133 -11.7133 -10.8281 -10.8281 0.6551 0.6551 1.1298 1.1298 1.6183 1.6183 2.3405 2.3405 3.0314 3.0314 3.9840 3.9840 4.2089 4.2089 4.4649 4.4649 5.4225 5.4225 5.8371 5.8371 7.3021 7.3021 13.0552 13.0552 16.4033 16.4033 17.7023 17.7023 k = 0.2803-0.2292-0.0919 ( 4489 PWs) bands (ev): -37.3403 -37.3403 -11.6828 -11.6828 -10.8240 -10.8240 0.6760 0.6760 1.1537 1.1537 1.5561 1.5561 2.3148 2.3148 3.0482 3.0482 3.9585 3.9585 4.1731 4.1731 4.4500 4.4500 5.3895 5.3895 5.8622 5.8622 7.3110 7.3110 13.0913 13.0913 16.4625 16.4625 17.6898 17.6898 k = 0.2879-0.2354-0.0944 ( 4490 PWs) bands (ev): -37.3396 -37.3396 -11.6523 -11.6523 -10.8200 -10.8200 0.6959 0.6959 1.1662 1.1662 1.5092 1.5092 2.2891 2.2891 3.0662 3.0662 3.9187 3.9187 4.1495 4.1495 4.4359 4.4359 5.3564 5.3564 5.8867 5.8867 7.3210 7.3210 13.1237 13.1237 16.5119 16.5119 17.6852 17.6852 k = 0.2955-0.2416-0.0969 ( 4486 PWs) bands (ev): -37.3389 -37.3389 -11.6220 -11.6220 -10.8160 -10.8160 0.7146 0.7146 1.1597 1.1597 1.4852 1.4852 2.2636 2.2636 3.0850 3.0850 3.8667 3.8667 4.1361 4.1361 4.4225 4.4225 5.3233 5.3233 5.9105 5.9105 7.3320 7.3320 13.1523 13.1523 16.5501 16.5501 17.6898 17.6898 k = 0.3030-0.2478-0.0993 ( 4485 PWs) bands (ev): -37.3383 -37.3383 -11.5918 -11.5918 -10.8120 -10.8120 0.7318 0.7318 1.1319 1.1319 1.4869 1.4869 2.2383 2.2383 3.1045 3.1045 3.8068 3.8068 4.1286 4.1286 4.4102 4.4102 5.2902 5.2902 5.9336 5.9336 7.3439 7.3439 13.1772 13.1772 16.5759 16.5759 17.7046 17.7046 k = 0.3106-0.2540-0.1018 ( 4487 PWs) bands (ev): -37.3376 -37.3376 -11.5618 -11.5618 -10.8081 -10.8081 0.7467 0.7467 1.0894 1.0894 1.5086 1.5086 2.2134 2.2134 3.1246 3.1246 3.7424 3.7424 4.1237 4.1237 4.3990 4.3990 5.2572 5.2572 5.9559 5.9559 7.3565 7.3565 13.1983 13.1983 16.5892 16.5892 17.7295 17.7295 k = 0.3182-0.2602-0.1043 ( 4485 PWs) bands (ev): -37.3370 -37.3370 -11.5322 -11.5322 -10.8043 -10.8043 0.7571 0.7571 1.0420 1.0420 1.5426 1.5426 2.1891 2.1891 3.1450 3.1450 3.6756 3.6756 4.1192 4.1192 4.3894 4.3894 5.2244 5.2244 5.9775 5.9775 7.3697 7.3697 13.2158 13.2158 16.5905 16.5905 17.7635 17.7635 k = 0.3258-0.2664-0.1068 ( 4488 PWs) bands (ev): -37.3364 -37.3364 -11.5029 -11.5029 -10.8006 -10.8006 0.7595 0.7595 0.9986 0.9986 1.5836 1.5836 2.1654 2.1654 3.1655 3.1655 3.6076 3.6076 4.1137 4.1137 4.3817 4.3817 5.1918 5.1918 5.9982 5.9982 7.3832 7.3832 13.2297 13.2297 16.5812 16.5812 17.8035 17.8035 k = 0.3333-0.2726-0.1093 ( 4487 PWs) bands (ev): -37.3358 -37.3358 -11.4741 -11.4741 -10.7969 -10.7969 0.7479 0.7479 0.9682 0.9682 1.6285 1.6285 2.1424 2.1424 3.1857 3.1857 3.5397 3.5397 4.1063 4.1063 4.3762 4.3762 5.1595 5.1595 6.0182 6.0182 7.3971 7.3971 13.2402 13.2402 16.5630 16.5630 17.8418 17.8418 k = 0.3409-0.2788-0.1118 ( 4488 PWs) bands (ev): -37.3352 -37.3352 -11.4459 -11.4459 -10.7934 -10.7934 0.7188 0.7188 0.9559 0.9559 1.6757 1.6757 2.1202 2.1202 3.2047 3.2047 3.4731 3.4731 4.0963 4.0963 4.3730 4.3730 5.1276 5.1276 6.0373 6.0373 7.4111 7.4111 13.2476 13.2476 16.5379 16.5379 17.8607 17.8607 k = 0.3485-0.2850-0.1142 ( 4489 PWs) bands (ev): -37.3346 -37.3346 -11.4183 -11.4183 -10.7900 -10.7900 0.6757 0.6757 0.9593 0.9593 1.7239 1.7239 2.0988 2.0988 3.2208 3.2208 3.4101 3.4101 4.0835 4.0835 4.3723 4.3723 5.0960 5.0960 6.0555 6.0555 7.4252 7.4252 13.2520 13.2520 16.5077 16.5077 17.8527 17.8527 k = 0.3561-0.2912-0.1167 ( 4487 PWs) bands (ev): -37.3340 -37.3340 -11.3914 -11.3914 -10.7867 -10.7867 0.6250 0.6250 0.9725 0.9725 1.7724 1.7724 2.0785 2.0785 3.2279 3.2279 3.3570 3.3570 4.0679 4.0679 4.3739 4.3739 5.0648 5.0648 6.0730 6.0730 7.4392 7.4392 13.2536 13.2536 16.4740 16.4740 17.8336 17.8336 k = 0.3636-0.2974-0.1192 ( 4488 PWs) bands (ev): -37.3335 -37.3335 -11.3653 -11.3653 -10.7835 -10.7835 0.5713 0.5713 0.9916 0.9916 1.8203 1.8203 2.0594 2.0594 3.2107 3.2107 3.3294 3.3294 4.0497 4.0497 4.3775 4.3775 5.0341 5.0341 6.0895 6.0895 7.4530 7.4530 13.2528 13.2528 16.4380 16.4380 17.8124 17.8124 k = 0.3712-0.3036-0.1217 ( 4484 PWs) bands (ev): -37.3330 -37.3330 -11.3400 -11.3400 -10.7804 -10.7804 0.5170 0.5170 1.0143 1.0143 1.8668 1.8668 2.0419 2.0419 3.1660 3.1660 3.3310 3.3310 4.0291 4.0291 4.3828 4.3828 5.0040 5.0040 6.1052 6.1052 7.4666 7.4666 13.2498 13.2498 16.4009 16.4009 17.7916 17.7916 k = 0.3788-0.3098-0.1242 ( 4485 PWs) bands (ev): -37.3325 -37.3325 -11.3157 -11.3157 -10.7775 -10.7775 0.4636 0.4636 1.0394 1.0394 1.9102 1.9102 2.0270 2.0270 3.1107 3.1107 3.3450 3.3450 4.0065 4.0065 4.3896 4.3896 4.9743 4.9743 6.1200 6.1200 7.4799 7.4799 13.2450 13.2450 16.3635 16.3635 17.7720 17.7720 k = 0.3864-0.3160-0.1267 ( 4483 PWs) bands (ev): -37.3320 -37.3320 -11.2924 -11.2924 -10.7748 -10.7748 0.4117 0.4117 1.0664 1.0664 1.9461 1.9461 2.0186 2.0186 3.0540 3.0540 3.3629 3.3629 3.9822 3.9822 4.3975 4.3975 4.9453 4.9453 6.1340 6.1340 7.4927 7.4927 13.2385 13.2385 16.3264 16.3264 17.7537 17.7537 k = 0.3939-0.3222-0.1291 ( 4482 PWs) bands (ev): -37.3316 -37.3316 -11.2702 -11.2702 -10.7722 -10.7722 0.3621 0.3621 1.0948 1.0948 1.9621 1.9621 2.0282 2.0282 2.9989 2.9989 3.3821 3.3821 3.9564 3.9564 4.4063 4.4063 4.9169 4.9169 6.1470 6.1470 7.5050 7.5050 13.2308 13.2308 16.2904 16.2904 17.7367 17.7367 k = 0.4015-0.3283-0.1316 ( 4483 PWs) bands (ev): -37.3312 -37.3312 -11.2492 -11.2492 -10.7697 -10.7697 0.3149 0.3149 1.1244 1.1244 1.9579 1.9579 2.0555 2.0555 2.9473 2.9473 3.4015 3.4015 3.9296 3.9296 4.4159 4.4159 4.8892 4.8892 6.1592 6.1592 7.5168 7.5168 13.2222 13.2222 16.2556 16.2556 17.7211 17.7211 k = 0.4091-0.3345-0.1341 ( 4486 PWs) bands (ev): -37.3308 -37.3308 -11.2294 -11.2294 -10.7675 -10.7675 0.2705 0.2705 1.1549 1.1549 1.9476 1.9476 2.0854 2.0854 2.9003 2.9003 3.4207 3.4207 3.9021 3.9021 4.4259 4.4259 4.8622 4.8622 6.1705 6.1705 7.5280 7.5280 13.2128 13.2128 16.2226 16.2226 17.7066 17.7066 k = 0.4167-0.3407-0.1366 ( 4484 PWs) bands (ev): -37.3304 -37.3304 -11.2109 -11.2109 -10.7653 -10.7653 0.2291 0.2291 1.1862 1.1862 1.9362 1.9362 2.1116 2.1116 2.8592 2.8592 3.4393 3.4393 3.8741 3.8741 4.4363 4.4363 4.8360 4.8360 6.1808 6.1808 7.5384 7.5384 13.2031 13.2031 16.1916 16.1916 17.6934 17.6934 k = 0.4242-0.3469-0.1391 ( 4485 PWs) bands (ev): -37.3301 -37.3301 -11.1938 -11.1938 -10.7634 -10.7634 0.1908 0.1908 1.2179 1.2179 1.9251 1.9251 2.1318 2.1318 2.8253 2.8253 3.4572 3.4572 3.8461 3.8461 4.4471 4.4471 4.8107 4.8107 6.1903 6.1903 7.5482 7.5482 13.1932 13.1932 16.1627 16.1627 17.6813 17.6813 k = 0.4318-0.3531-0.1416 ( 4488 PWs) bands (ev): -37.3298 -37.3298 -11.1781 -11.1781 -10.7617 -10.7617 0.1558 0.1558 1.2498 1.2498 1.9147 1.9147 2.1447 2.1447 2.7993 2.7993 3.4740 3.4740 3.8183 3.8183 4.4581 4.4581 4.7863 4.7863 6.1989 6.1989 7.5571 7.5571 13.1835 13.1835 16.1362 16.1362 17.6703 17.6703 k = 0.4394-0.3593-0.1440 ( 4486 PWs) bands (ev): -37.3295 -37.3295 -11.1639 -11.1639 -10.7601 -10.7601 0.1242 0.1242 1.2814 1.2814 1.9051 1.9051 2.1496 2.1496 2.7817 2.7817 3.4897 3.4897 3.7913 3.7913 4.4692 4.4692 4.7629 4.7629 6.2066 6.2066 7.5653 7.5653 13.1742 13.1742 16.1122 16.1122 17.6604 17.6604 k = 0.4470-0.3655-0.1465 ( 4484 PWs) bands (ev): -37.3293 -37.3293 -11.1512 -11.1512 -10.7587 -10.7587 0.0961 0.0961 1.3125 1.3125 1.8965 1.8965 2.1469 2.1469 2.7721 2.7721 3.5040 3.5040 3.7654 3.7654 4.4805 4.4805 4.7406 4.7406 6.2133 6.2133 7.5725 7.5725 13.1654 13.1654 16.0907 16.0907 17.6517 17.6517 k = 0.4545-0.3717-0.1490 ( 4490 PWs) bands (ev): -37.3291 -37.3291 -11.1401 -11.1401 -10.7575 -10.7575 0.0716 0.0716 1.3423 1.3423 1.8889 1.8889 2.1380 2.1380 2.7693 2.7693 3.5168 3.5168 3.7412 3.7412 4.4918 4.4918 4.7195 4.7195 6.2192 6.2192 7.5789 7.5789 13.1574 13.1574 16.0720 16.0720 17.6440 17.6440 k = 0.4621-0.3779-0.1515 ( 4487 PWs) bands (ev): -37.3289 -37.3289 -11.1307 -11.1307 -10.7565 -10.7565 0.0508 0.0508 1.3703 1.3703 1.8823 1.8823 2.1248 2.1248 2.7716 2.7716 3.5279 3.5279 3.7193 3.7193 4.5030 4.5030 4.6999 4.6999 6.2242 6.2242 7.5843 7.5843 13.1504 13.1504 16.0561 16.0561 17.6376 17.6376 k = 0.4697-0.3841-0.1540 ( 4487 PWs) bands (ev): -37.3287 -37.3287 -11.1229 -11.1229 -10.7556 -10.7556 0.0336 0.0336 1.3954 1.3954 1.8767 1.8767 2.1095 2.1095 2.7769 2.7769 3.5372 3.5372 3.7002 3.7002 4.5139 4.5139 4.6819 4.6819 6.2282 6.2282 7.5888 7.5888 13.1444 13.1444 16.0430 16.0430 17.6322 17.6322 k = 0.4773-0.3903-0.1565 ( 4492 PWs) bands (ev): -37.3286 -37.3286 -11.1168 -11.1168 -10.7550 -10.7550 0.0202 0.0202 1.4168 1.4168 1.8723 1.8723 2.0945 2.0945 2.7832 2.7832 3.5445 3.5445 3.6846 3.6846 4.5241 4.5241 4.6662 4.6662 6.2314 6.2314 7.5923 7.5923 13.1396 13.1396 16.0327 16.0327 17.6281 17.6281 k = 0.4848-0.3965-0.1589 ( 4486 PWs) bands (ev): -37.3285 -37.3285 -11.1124 -11.1124 -10.7545 -10.7545 0.0106 0.0106 1.4331 1.4331 1.8690 1.8690 2.0821 2.0821 2.7889 2.7889 3.5498 3.5498 3.6730 3.6730 4.5330 4.5330 4.6533 4.6533 6.2337 6.2337 7.5948 7.5948 13.1362 13.1362 16.0254 16.0254 17.6251 17.6251 k = 0.4924-0.4027-0.1614 ( 4487 PWs) bands (ev): -37.3285 -37.3285 -11.1098 -11.1098 -10.7542 -10.7542 0.0049 0.0049 1.4435 1.4435 1.8670 1.8670 2.0738 2.0738 2.7929 2.7929 3.5530 3.5530 3.6658 3.6658 4.5393 4.5393 4.6446 4.6446 6.2350 6.2350 7.5964 7.5964 13.1341 13.1341 16.0209 16.0209 17.6233 17.6233 k = 0.5000-0.4089-0.1639 ( 4488 PWs) bands (ev): -37.3285 -37.3285 -11.1089 -11.1089 -10.7541 -10.7541 0.0029 0.0029 1.4471 1.4471 1.8663 1.8663 2.0709 2.0709 2.7943 2.7943 3.5541 3.5541 3.6634 3.6634 4.5416 4.5416 4.6415 4.6415 6.2355 6.2355 7.5969 7.5969 13.1334 13.1334 16.0195 16.0195 17.6227 17.6227 k = 0.5000-0.4089 0.1641 ( 4488 PWs) bands (ev): -37.3285 -37.3285 -11.0389 -11.0389 -10.8319 -10.8319 -0.0460 -0.0460 1.7482 1.7482 1.8064 1.8064 1.9443 1.9443 2.8138 2.8138 3.5666 3.5666 3.6627 3.6627 4.5692 4.5692 4.8795 4.8795 5.9862 5.9862 7.1407 7.1407 14.2527 14.2527 16.0646 16.0646 16.4554 16.4554 k = 0.4924-0.4027 0.1617 ( 4488 PWs) bands (ev): -37.3285 -37.3285 -11.0401 -11.0401 -10.8317 -10.8317 -0.0440 -0.0440 1.7411 1.7411 1.7983 1.7983 1.9614 1.9614 2.8092 2.8092 3.5658 3.5658 3.6658 3.6658 4.5683 4.5683 4.8809 4.8809 5.9860 5.9860 7.1410 7.1410 14.2530 14.2530 16.0640 16.0640 16.4574 16.4574 k = 0.4848-0.3965 0.1592 ( 4485 PWs) bands (ev): -37.3285 -37.3285 -11.0435 -11.0435 -10.8312 -10.8312 -0.0380 -0.0380 1.7167 1.7167 1.7888 1.7888 2.0011 2.0011 2.7954 2.7954 3.5633 3.5633 3.6752 3.6752 4.5655 4.5655 4.8853 4.8853 5.9853 5.9853 7.1419 7.1419 14.2536 14.2536 16.0621 16.0621 16.4632 16.4632 k = 0.4773-0.3903 0.1567 ( 4491 PWs) bands (ev): -37.3286 -37.3286 -11.0492 -11.0492 -10.8303 -10.8303 -0.0280 -0.0280 1.6791 1.6791 1.7867 1.7867 2.0503 2.0503 2.7732 2.7732 3.5591 3.5591 3.6901 3.6901 4.5610 4.5610 4.8924 4.8924 5.9841 5.9841 7.1434 7.1434 14.2546 14.2546 16.0590 16.0590 16.4730 16.4730 k = 0.4697-0.3841 0.1542 ( 4485 PWs) bands (ev): -37.3287 -37.3287 -11.0571 -11.0571 -10.8292 -10.8292 -0.0140 -0.0140 1.6366 1.6366 1.7888 1.7888 2.1040 2.1040 2.7437 2.7437 3.5530 3.5530 3.7099 3.7099 4.5551 4.5551 4.9019 4.9019 5.9824 5.9824 7.1455 7.1455 14.2557 14.2557 16.0547 16.0547 16.4868 16.4868 k = 0.4621-0.3779 0.1517 ( 4488 PWs) bands (ev): -37.3289 -37.3289 -11.0670 -11.0670 -10.8280 -10.8280 0.0039 0.0039 1.5927 1.5927 1.7932 1.7932 2.1604 2.1604 2.7079 2.7079 3.5452 3.5452 3.7333 3.7333 4.5481 4.5481 4.9136 4.9136 5.9803 5.9803 7.1481 7.1481 14.2570 14.2570 16.0491 16.0491 16.5046 16.5046 k = 0.4545-0.3717 0.1492 ( 4490 PWs) bands (ev): -37.3290 -37.3290 -11.0788 -11.0788 -10.8266 -10.8266 0.0257 0.0257 1.5488 1.5488 1.7993 1.7993 2.2185 2.2185 2.6672 2.6672 3.5357 3.5357 3.7595 3.7595 4.5403 4.5403 4.9272 4.9272 5.9777 5.9777 7.1511 7.1511 14.2581 14.2581 16.0424 16.0424 16.5265 16.5265 k = 0.4470-0.3655 0.1467 ( 4485 PWs) bands (ev): -37.3293 -37.3293 -11.0924 -11.0924 -10.8253 -10.8253 0.0513 0.0513 1.5057 1.5057 1.8068 1.8068 2.2772 2.2772 2.6230 2.6230 3.5245 3.5245 3.7876 3.7876 4.5320 4.5320 4.9425 4.9425 5.9745 5.9745 7.1547 7.1547 14.2589 14.2589 16.0347 16.0347 16.5525 16.5525 k = 0.4394-0.3593 0.1442 ( 4486 PWs) bands (ev): -37.3295 -37.3295 -11.1078 -11.1078 -10.8240 -10.8240 0.0806 0.0806 1.4635 1.4635 1.8155 1.8155 2.3350 2.3350 2.5776 2.5776 3.5118 3.5118 3.8166 3.8166 4.5233 4.5233 4.9592 4.9592 5.9709 5.9709 7.1586 7.1586 14.2590 14.2590 16.0261 16.0261 16.5827 16.5827 k = 0.4318-0.3531 0.1418 ( 4491 PWs) bands (ev): -37.3298 -37.3298 -11.1247 -11.1247 -10.8228 -10.8228 0.1135 0.1135 1.4224 1.4224 1.8254 1.8254 2.3859 2.3859 2.5374 2.5374 3.4976 3.4976 3.8460 3.8460 4.5147 4.5147 4.9771 4.9771 5.9667 5.9667 7.1628 7.1628 14.2580 14.2580 16.0168 16.0168 16.6171 16.6171 k = 0.4242-0.3469 0.1393 ( 4487 PWs) bands (ev): -37.3301 -37.3301 -11.1432 -11.1432 -10.8218 -10.8218 0.1499 0.1499 1.3827 1.3827 1.8364 1.8364 2.4056 2.4056 2.5274 2.5274 3.4821 3.4821 3.8752 3.8752 4.5063 4.5063 4.9961 4.9961 5.9620 5.9620 7.1673 7.1673 14.2557 14.2557 16.0069 16.0069 16.6557 16.6557 k = 0.4167-0.3407 0.1368 ( 4483 PWs) bands (ev): -37.3304 -37.3304 -11.1631 -11.1631 -10.8209 -10.8209 0.1897 0.1897 1.3443 1.3443 1.8483 1.8483 2.3748 2.3748 2.5672 2.5672 3.4654 3.4654 3.9036 3.9036 4.4983 4.4983 5.0161 5.0161 5.9567 5.9567 7.1719 7.1719 14.2517 14.2517 15.9968 15.9968 16.6985 16.6985 k = 0.4091-0.3345 0.1343 ( 4486 PWs) bands (ev): -37.3308 -37.3308 -11.1843 -11.1843 -10.8203 -10.8203 0.2326 0.2326 1.3073 1.3073 1.8611 1.8611 2.3244 2.3244 2.6264 2.6264 3.4476 3.4476 3.9310 3.9310 4.4909 4.4909 5.0369 5.0369 5.9508 5.9508 7.1767 7.1767 14.2454 14.2454 15.9868 15.9868 16.7453 16.7453 k = 0.4015-0.3283 0.1318 ( 4483 PWs) bands (ev): -37.3312 -37.3312 -11.2068 -11.2068 -10.8199 -10.8199 0.2787 0.2787 1.2718 1.2718 1.8745 1.8745 2.2686 2.2686 2.6914 2.6914 3.4289 3.4289 3.9569 3.9569 4.4844 4.4844 5.0584 5.0584 5.9444 5.9444 7.1816 7.1816 14.2366 14.2366 15.9769 15.9769 16.7963 16.7963 k = 0.3939-0.3222 0.1293 ( 4481 PWs) bands (ev): -37.3316 -37.3316 -11.2304 -11.2304 -10.8197 -10.8197 0.3275 0.3275 1.2378 1.2378 1.8881 1.8881 2.2112 2.2112 2.7588 2.7588 3.4092 3.4092 3.9809 3.9809 4.4789 4.4789 5.0806 5.0806 5.9374 5.9374 7.1864 7.1864 14.2248 14.2248 15.9676 15.9676 16.8513 16.8513 k = 0.3864-0.3160 0.1268 ( 4483 PWs) bands (ev): -37.3320 -37.3320 -11.2551 -11.2551 -10.8197 -10.8197 0.3790 0.3790 1.2054 1.2054 1.9010 1.9010 2.1544 2.1544 2.8278 2.8278 3.3889 3.3889 4.0028 4.0028 4.4747 4.4747 5.1034 5.1034 5.9298 5.9298 7.1912 7.1912 14.2096 14.2096 15.9590 15.9590 16.9103 16.9103 k = 0.3788-0.3098 0.1243 ( 4484 PWs) bands (ev): -37.3325 -37.3325 -11.2808 -11.2808 -10.8199 -10.8199 0.4327 0.4327 1.1747 1.1747 1.9110 1.9110 2.1009 2.1009 2.8978 2.8978 3.3680 3.3680 4.0224 4.0224 4.4720 4.4720 5.1267 5.1267 5.9215 5.9215 7.1959 7.1959 14.1907 14.1907 15.9513 15.9513 16.9732 16.9732 k = 0.3712-0.3036 0.1219 ( 4485 PWs) bands (ev): -37.3330 -37.3330 -11.3074 -11.3074 -10.8204 -10.8204 0.4883 0.4883 1.1458 1.1458 1.9124 1.9124 2.0569 2.0569 2.9686 2.9686 3.3467 3.3467 4.0394 4.0394 4.4711 4.4711 5.1505 5.1505 5.9126 5.9126 7.2004 7.2004 14.1678 14.1678 15.9446 15.9446 17.0398 17.0398 k = 0.3636-0.2974 0.1194 ( 4488 PWs) bands (ev): -37.3335 -37.3335 -11.3349 -11.3349 -10.8211 -10.8211 0.5452 0.5452 1.1189 1.1189 1.8948 1.8948 2.0332 2.0332 3.0397 3.0397 3.3253 3.3253 4.0537 4.0537 4.4719 4.4719 5.1748 5.1748 5.9031 5.9031 7.2047 7.2047 14.1405 14.1405 15.9388 15.9388 17.1102 17.1102 k = 0.3561-0.2912 0.1169 ( 4489 PWs) bands (ev): -37.3340 -37.3340 -11.3631 -11.3631 -10.8220 -10.8220 0.6028 0.6028 1.0943 1.0943 1.8561 1.8561 2.0325 2.0325 3.1106 3.1106 3.3043 3.3043 4.0652 4.0652 4.4748 4.4748 5.1995 5.1995 5.8930 5.8930 7.2087 7.2087 14.1088 14.1088 15.9339 15.9339 17.1841 17.1841 k = 0.3485-0.2850 0.1144 ( 4488 PWs) bands (ev): -37.3346 -37.3346 -11.3921 -11.3921 -10.8231 -10.8231 0.6598 0.6598 1.0728 1.0728 1.8066 1.8066 2.0447 2.0447 3.1791 3.1791 3.2858 3.2858 4.0738 4.0738 4.4797 4.4797 5.2245 5.2245 5.8822 5.8822 7.2126 7.2126 14.0725 14.0725 15.9297 15.9297 17.2615 17.2615 k = 0.3409-0.2788 0.1119 ( 4490 PWs) bands (ev): -37.3352 -37.3352 -11.4216 -11.4216 -10.8245 -10.8245 0.7145 0.7145 1.0553 1.0553 1.7542 1.7542 2.0628 2.0628 3.2279 3.2279 3.2873 3.2873 4.0798 4.0798 4.4865 4.4865 5.2498 5.2498 5.8708 5.8708 7.2161 7.2161 14.0317 14.0317 15.9260 15.9260 17.3419 17.3419 k = 0.3333-0.2726 0.1094 ( 4485 PWs) bands (ev): -37.3357 -37.3357 -11.4517 -11.4517 -10.8260 -10.8260 0.7639 0.7639 1.0440 1.0440 1.7025 1.7025 2.0839 2.0839 3.2234 3.2234 3.3420 3.3420 4.0833 4.0833 4.4952 4.4952 5.2754 5.2754 5.8588 5.8588 7.2195 7.2195 13.9864 13.9864 15.9222 15.9222 17.4252 17.4252 k = 0.3258-0.2664 0.1069 ( 4486 PWs) bands (ev): -37.3364 -37.3364 -11.4822 -11.4822 -10.8276 -10.8276 0.8034 0.8034 1.0419 1.0419 1.6540 1.6540 2.1069 2.1069 3.2042 3.2042 3.4114 3.4114 4.0844 4.0844 4.5057 4.5057 5.3011 5.3011 5.8461 5.8461 7.2226 7.2226 13.9367 13.9367 15.9181 15.9181 17.5110 17.5110 k = 0.3182-0.2602 0.1045 ( 4486 PWs) bands (ev): -37.3370 -37.3370 -11.5131 -11.5131 -10.8295 -10.8295 0.8282 0.8282 1.0517 1.0517 1.6114 1.6114 2.1313 2.1313 3.1831 3.1831 3.4827 3.4827 4.0836 4.0836 4.5177 4.5177 5.3270 5.3270 5.8328 5.8328 7.2255 7.2255 13.8828 13.8828 15.9130 15.9130 17.5984 17.5984 k = 0.3106-0.2540 0.1020 ( 4487 PWs) bands (ev): -37.3376 -37.3376 -11.5444 -11.5444 -10.8315 -10.8315 0.8373 0.8373 1.0710 1.0710 1.5782 1.5782 2.1567 2.1567 3.1616 3.1616 3.5541 3.5541 4.0812 4.0812 4.5311 4.5311 5.3530 5.3530 5.8189 5.8189 7.2282 7.2282 13.8248 13.8248 15.9063 15.9063 17.6867 17.6867 k = 0.3030-0.2478 0.0995 ( 4485 PWs) bands (ev): -37.3383 -37.3383 -11.5758 -11.5758 -10.8336 -10.8336 0.8343 0.8343 1.0915 1.0915 1.5590 1.5590 2.1829 2.1829 3.1404 3.1404 3.6251 3.6251 4.0773 4.0773 4.5458 4.5458 5.3789 5.3789 5.8044 5.8044 7.2309 7.2309 13.7632 13.7632 15.8975 15.8975 17.7742 17.7742 k = 0.2955-0.2416 0.0970 ( 4487 PWs) bands (ev): -37.3389 -37.3389 -11.6074 -11.6074 -10.8359 -10.8359 0.8240 0.8240 1.1035 1.1035 1.5589 1.5589 2.2098 2.2098 3.1196 3.1196 3.6952 3.6952 4.0724 4.0724 4.5616 4.5616 5.4048 5.4048 5.7895 5.7895 7.2336 7.2336 13.6980 13.6980 15.8860 15.8860 17.8584 17.8584 k = 0.2879-0.2354 0.0945 ( 4489 PWs) bands (ev): -37.3396 -37.3396 -11.6391 -11.6391 -10.8384 -10.8384 0.8093 0.8093 1.1017 1.1017 1.5801 1.5801 2.2370 2.2370 3.0995 3.0995 3.7641 3.7641 4.0666 4.0666 4.5786 4.5786 5.4304 5.4304 5.7741 5.7741 7.2364 7.2364 13.6297 13.6297 15.8712 15.8712 17.9355 17.9355 k = 0.2803-0.2292 0.0920 ( 4487 PWs) bands (ev): -37.3403 -37.3403 -11.6708 -11.6708 -10.8409 -10.8409 0.7915 0.7915 1.0867 1.0867 1.6206 1.6206 2.2646 2.2646 3.0803 3.0803 3.8313 3.8313 4.0604 4.0604 4.5965 4.5965 5.4558 5.4558 5.7584 5.7584 7.2395 7.2395 13.5584 13.5584 15.8527 15.8527 18.0006 18.0006 k = 0.2727-0.2230 0.0895 ( 4491 PWs) bands (ev): -37.3410 -37.3410 -11.7024 -11.7024 -10.8436 -10.8436 0.7713 0.7713 1.0627 1.0627 1.6755 1.6755 2.2922 2.2922 3.0622 3.0622 3.8963 3.8963 4.0541 4.0541 4.6155 4.6155 5.4805 5.4805 5.7425 5.7425 7.2428 7.2428 13.4846 13.4846 15.8299 15.8299 18.0496 18.0496 k = 0.2652-0.2168 0.0870 ( 4488 PWs) bands (ev): -37.3417 -37.3417 -11.7340 -11.7340 -10.8463 -10.8463 0.7486 0.7486 1.0341 1.0341 1.7403 1.7403 2.3198 2.3198 3.0454 3.0454 3.9578 3.9578 4.0490 4.0490 4.6355 4.6355 5.5044 5.5044 5.7269 5.7269 7.2466 7.2466 13.4084 13.4084 15.8026 15.8026 18.0828 18.0828 k = 0.2576-0.2106 0.0846 ( 4489 PWs) bands (ev): -37.3423 -37.3423 -11.7653 -11.7653 -10.8492 -10.8492 0.7232 0.7232 1.0042 1.0042 1.8115 1.8115 2.3469 2.3469 3.0302 3.0302 4.0080 4.0080 4.0525 4.0525 4.6567 4.6567 5.5268 5.5268 5.7122 5.7122 7.2510 7.2510 13.3302 13.3302 15.7706 15.7706 18.1046 18.1046 k = 0.2500-0.2044 0.0821 ( 4490 PWs) bands (ev): -37.3430 -37.3430 -11.7964 -11.7964 -10.8521 -10.8521 0.6950 0.6950 0.9755 0.9755 1.8869 1.8869 2.3735 2.3735 3.0168 3.0168 4.0209 4.0209 4.0906 4.0906 4.6789 4.6789 5.5466 5.5466 5.6993 5.6993 7.2561 7.2561 13.2503 13.2503 15.7338 15.7338 18.1204 18.1204 k = 0.2424-0.1982 0.0796 ( 4493 PWs) bands (ev): -37.3437 -37.3437 -11.8272 -11.8272 -10.8551 -10.8551 0.6638 0.6638 0.9492 0.9492 1.9650 1.9650 2.3991 2.3991 3.0057 3.0057 4.0169 4.0169 4.1426 4.1426 4.7023 4.7023 5.5618 5.5618 5.6905 5.6905 7.2622 7.2622 13.1689 13.1689 15.6923 15.6923 18.1340 18.1340 k = 0.2348-0.1921 0.0771 ( 4490 PWs) bands (ev): -37.3444 -37.3444 -11.8575 -11.8575 -10.8582 -10.8582 0.6299 0.6299 0.9260 0.9260 2.0446 2.0446 2.4235 2.4235 2.9972 2.9972 4.0108 4.0108 4.1936 4.1936 4.7267 4.7267 5.5694 5.5694 5.6886 5.6886 7.2694 7.2694 13.0864 13.0864 15.6462 15.6462 18.1479 18.1479 k = 0.2273-0.1859 0.0746 ( 4492 PWs) bands (ev): -37.3451 -37.3451 -11.8875 -11.8875 -10.8613 -10.8613 0.5935 0.5935 0.9061 0.9061 2.1249 2.1249 2.4464 2.4464 2.9917 2.9917 4.0044 4.0044 4.2417 4.2417 4.7522 4.7522 5.5675 5.5675 5.6956 5.6956 7.2779 7.2779 13.0028 13.0028 15.5958 15.5958 18.1632 18.1632 k = 0.2197-0.1797 0.0721 ( 4494 PWs) bands (ev): -37.3458 -37.3458 -11.9170 -11.9170 -10.8644 -10.8644 0.5553 0.5553 0.8894 0.8894 2.2049 2.2049 2.4677 2.4677 2.9896 2.9896 3.9981 3.9981 4.2865 4.2865 4.7784 4.7784 5.5575 5.5575 5.7101 5.7101 7.2877 7.2877 12.9186 12.9186 15.5414 15.5414 18.1807 18.1807 k = 0.2121-0.1735 0.0696 ( 4493 PWs) bands (ev): -37.3465 -37.3465 -11.9459 -11.9459 -10.8676 -10.8676 0.5157 0.5157 0.8755 0.8755 2.2835 2.2835 2.4877 2.4877 2.9912 2.9912 3.9924 3.9924 4.3277 4.3277 4.8051 4.8051 5.5425 5.5425 5.7293 5.7293 7.2992 7.2992 12.8340 12.8340 15.4833 15.4833 18.2004 18.2004 k = 0.2045-0.1673 0.0671 ( 4495 PWs) bands (ev): -37.3472 -37.3472 -11.9743 -11.9743 -10.8708 -10.8708 0.4755 0.4755 0.8639 0.8639 2.3583 2.3583 2.5079 2.5079 2.9970 2.9970 3.9872 3.9872 4.3656 4.3656 4.8318 4.8318 5.5246 5.5246 5.7509 5.7509 7.3124 7.3124 12.7491 12.7491 15.4221 15.4221 18.2223 18.2223 k = 0.1970-0.1611 0.0647 ( 4492 PWs) bands (ev): -37.3478 -37.3478 -12.0020 -12.0020 -10.8740 -10.8740 0.4350 0.4350 0.8545 0.8545 2.4236 2.4236 2.5337 2.5337 3.0071 3.0071 3.9828 3.9828 4.4003 4.4003 4.8581 4.8581 5.5050 5.5050 5.7739 5.7739 7.3275 7.3275 12.6643 12.6643 15.3582 15.3582 18.2463 18.2463 k = 0.1894-0.1549 0.0622 ( 4489 PWs) bands (ev): -37.3485 -37.3485 -12.0290 -12.0290 -10.8772 -10.8772 0.3946 0.3946 0.8467 0.8467 2.4675 2.4675 2.5763 2.5763 3.0214 3.0214 3.9792 3.9792 4.4320 4.4320 4.8835 4.8835 5.4844 5.4844 5.7977 5.7977 7.3446 7.3446 12.5798 12.5798 15.2919 15.2919 18.2722 18.2722 k = 0.1818-0.1487 0.0597 ( 4492 PWs) bands (ev): -37.3491 -37.3491 -12.0554 -12.0554 -10.8804 -10.8804 0.3548 0.3548 0.8405 0.8405 2.4883 2.4883 2.6372 2.6372 3.0397 3.0397 3.9767 3.9767 4.4611 4.4611 4.9074 4.9074 5.4632 5.4632 5.8218 5.8218 7.3637 7.3637 12.4957 12.4957 15.2239 15.2239 18.2995 18.2995 k = 0.1742-0.1425 0.0572 ( 4492 PWs) bands (ev): -37.3497 -37.3497 -12.0809 -12.0809 -10.8835 -10.8835 0.3156 0.3156 0.8355 0.8355 2.4969 2.4969 2.7054 2.7054 3.0619 3.0619 3.9752 3.9752 4.4879 4.4879 4.9293 4.9293 5.4419 5.4419 5.8460 5.8460 7.3849 7.3849 12.4125 12.4125 15.1545 15.1545 18.3280 18.3280 k = 0.1667-0.1363 0.0547 ( 4490 PWs) bands (ev): -37.3503 -37.3503 -12.1056 -12.1056 -10.8866 -10.8866 0.2774 0.2774 0.8316 0.8316 2.4998 2.4998 2.7744 2.7744 3.0875 3.0875 3.9751 3.9751 4.5127 4.5127 4.9486 4.9486 5.4206 5.4206 5.8702 5.8702 7.4083 7.4083 12.3302 12.3302 15.0841 15.0841 18.3575 18.3575 k = 0.1591-0.1301 0.0522 ( 4496 PWs) bands (ev): -37.3509 -37.3509 -12.1295 -12.1295 -10.8897 -10.8897 0.2403 0.2403 0.8286 0.8286 2.4993 2.4993 2.8418 2.8418 3.1162 3.1162 3.9764 3.9764 4.5357 4.5357 4.9651 4.9651 5.3996 5.3996 5.8941 5.8941 7.4337 7.4337 12.2491 12.2491 15.0133 15.0133 18.3874 18.3874 k = 0.1515-0.1239 0.0497 ( 4492 PWs) bands (ev): -37.3515 -37.3515 -12.1525 -12.1525 -10.8927 -10.8927 0.2044 0.2044 0.8265 0.8265 2.4966 2.4966 2.9063 2.9063 3.1477 3.1477 3.9792 3.9792 4.5574 4.5574 4.9783 4.9783 5.3793 5.3793 5.9177 5.9177 7.4610 7.4610 12.1695 12.1695 14.9424 14.9424 18.4177 18.4177 k = 0.1439-0.1177 0.0473 ( 4495 PWs) bands (ev): -37.3521 -37.3521 -12.1746 -12.1746 -10.8956 -10.8956 0.1699 0.1699 0.8250 0.8250 2.4923 2.4923 2.9670 2.9670 3.1816 3.1816 3.9837 3.9837 4.5778 4.5778 4.9879 4.9879 5.3598 5.3598 5.9407 5.9407 7.4902 7.4902 12.0915 12.0915 14.8718 14.8718 18.4480 18.4480 k = 0.1364-0.1115 0.0448 ( 4490 PWs) bands (ev): -37.3526 -37.3526 -12.1957 -12.1957 -10.8985 -10.8985 0.1368 0.1368 0.8241 0.8241 2.4870 2.4870 3.0234 3.0234 3.2177 3.2177 3.9901 3.9901 4.5971 4.5971 4.9939 4.9939 5.3414 5.3414 5.9631 5.9631 7.5210 7.5210 12.0155 12.0155 14.8020 14.8020 18.4781 18.4781 k = 0.1288-0.1053 0.0423 ( 4494 PWs) bands (ev): -37.3531 -37.3531 -12.2159 -12.2159 -10.9013 -10.9013 0.1052 0.1052 0.8238 0.8238 2.4809 2.4809 3.0751 3.0751 3.2554 3.2554 3.9984 3.9984 4.6155 4.6155 4.9960 4.9960 5.3243 5.3243 5.9848 5.9848 7.5531 7.5531 11.9417 11.9417 14.7332 14.7332 18.5076 18.5076 k = 0.1212-0.0991 0.0398 ( 4493 PWs) bands (ev): -37.3536 -37.3536 -12.2350 -12.2350 -10.9039 -10.9039 0.0752 0.0752 0.8238 0.8238 2.4744 2.4744 3.1221 3.1221 3.2941 3.2941 4.0088 4.0088 4.6330 4.6330 4.9944 4.9944 5.3088 5.3088 6.0055 6.0055 7.5864 7.5864 11.8703 11.8703 14.6659 14.6659 18.5365 18.5365 k = 0.1136-0.0929 0.0373 ( 4491 PWs) bands (ev): -37.3541 -37.3541 -12.2531 -12.2531 -10.9065 -10.9065 0.0468 0.0468 0.8242 0.8242 2.4677 2.4677 3.1644 3.1644 3.3332 3.3332 4.0212 4.0212 4.6498 4.6498 4.9892 4.9892 5.2948 5.2948 6.0253 6.0253 7.6204 7.6204 11.8015 11.8015 14.6004 14.6004 18.5645 18.5645 k = 0.1061-0.0867 0.0348 ( 4487 PWs) bands (ev): -37.3545 -37.3545 -12.2702 -12.2702 -10.9089 -10.9089 0.0201 0.0201 0.8249 0.8249 2.4610 2.4610 3.2025 3.2025 3.3719 3.3719 4.0355 4.0355 4.6658 4.6658 4.9808 4.9808 5.2825 5.2825 6.0440 6.0440 7.6549 7.6549 11.7357 11.7357 14.5371 14.5371 18.5914 18.5914 k = 0.0985-0.0805 0.0323 ( 4487 PWs) bands (ev): -37.3549 -37.3549 -12.2862 -12.2862 -10.9112 -10.9112 -0.0050 -0.0050 0.8258 0.8258 2.4543 2.4543 3.2367 3.2367 3.4093 3.4093 4.0516 4.0516 4.6810 4.6810 4.9695 4.9695 5.2716 5.2716 6.0616 6.0616 7.6894 7.6894 11.6730 11.6730 14.4764 14.4764 18.6171 18.6171 k = 0.0909-0.0743 0.0298 ( 4486 PWs) bands (ev): -37.3553 -37.3553 -12.3010 -12.3010 -10.9134 -10.9134 -0.0282 -0.0282 0.8269 0.8269 2.4479 2.4479 3.2674 3.2674 3.4450 3.4450 4.0693 4.0693 4.6955 4.6955 4.9559 4.9559 5.2622 5.2622 6.0779 6.0779 7.7235 7.7235 11.6136 11.6136 14.4185 14.4185 18.6414 18.6414 k = 0.0833-0.0681 0.0274 ( 4486 PWs) bands (ev): -37.3557 -37.3557 -12.3148 -12.3148 -10.9154 -10.9154 -0.0497 -0.0497 0.8281 0.8281 2.4417 2.4417 3.2947 3.2947 3.4787 3.4787 4.0882 4.0882 4.7091 4.7091 4.9406 4.9406 5.2541 5.2541 6.0931 6.0931 7.7568 7.7568 11.5580 11.5580 14.3638 14.3638 18.6643 18.6643 k = 0.0758-0.0620 0.0249 ( 4482 PWs) bands (ev): -37.3560 -37.3560 -12.3274 -12.3274 -10.9173 -10.9173 -0.0694 -0.0694 0.8294 0.8294 2.4359 2.4359 3.3189 3.3189 3.5100 3.5100 4.1079 4.1079 4.7218 4.7218 4.9240 4.9240 5.2470 5.2470 6.1069 6.1069 7.7890 7.7890 11.5062 11.5062 14.3125 14.3125 18.6855 18.6855 k = 0.0682-0.0558 0.0224 ( 4479 PWs) bands (ev): -37.3563 -37.3563 -12.3389 -12.3389 -10.9190 -10.9190 -0.0873 -0.0873 0.8306 0.8306 2.4305 2.4305 3.3401 3.3401 3.5389 3.5389 4.1278 4.1278 4.7335 4.7335 4.9068 4.9068 5.2410 5.2410 6.1194 6.1194 7.8195 7.8195 11.4585 11.4585 14.2651 14.2651 18.7050 18.7050 k = 0.0606-0.0496 0.0199 ( 4484 PWs) bands (ev): -37.3566 -37.3566 -12.3492 -12.3492 -10.9206 -10.9206 -0.1033 -0.1033 0.8319 0.8319 2.4256 2.4256 3.3585 3.3585 3.5652 3.5652 4.1476 4.1476 4.7441 4.7441 4.8896 4.8896 5.2358 5.2358 6.1306 6.1306 7.8481 7.8481 11.4152 11.4152 14.2218 14.2218 18.7227 18.7227 k = 0.0530-0.0434 0.0174 ( 4484 PWs) bands (ev): -37.3568 -37.3568 -12.3583 -12.3583 -10.9220 -10.9220 -0.1175 -0.1175 0.8331 0.8331 2.4212 2.4212 3.3743 3.3743 3.5890 3.5890 4.1666 4.1666 4.7535 4.7535 4.8727 4.8727 5.2315 5.2315 6.1405 6.1405 7.8743 7.8743 11.3764 11.3764 14.1829 14.1829 18.7384 18.7384 k = 0.0455-0.0372 0.0149 ( 4483 PWs) bands (ev): -37.3570 -37.3570 -12.3662 -12.3662 -10.9232 -10.9232 -0.1299 -0.1299 0.8342 0.8342 2.4173 2.4173 3.3875 3.3875 3.6101 3.6101 4.1844 4.1844 4.7617 4.7617 4.8568 4.8568 5.2279 5.2279 6.1490 6.1490 7.8977 7.8977 11.3424 11.3424 14.1486 14.1486 18.7523 18.7523 k = 0.0379-0.0310 0.0124 ( 4481 PWs) bands (ev): -37.3572 -37.3572 -12.3729 -12.3729 -10.9242 -10.9242 -0.1403 -0.1403 0.8352 0.8352 2.4140 2.4140 3.3983 3.3983 3.6283 3.6283 4.2004 4.2004 4.7685 4.7685 4.8424 4.8424 5.2250 5.2250 6.1562 6.1562 7.9182 7.9182 11.3133 11.3133 14.1191 14.1191 18.7640 18.7640 k = 0.0303-0.0248 0.0099 ( 4481 PWs) bands (ev): -37.3573 -37.3573 -12.3784 -12.3784 -10.9251 -10.9251 -0.1489 -0.1489 0.8360 0.8360 2.4113 2.4113 3.4069 3.4069 3.6435 3.6435 4.2143 4.2143 4.7739 4.7739 4.8301 4.8301 5.2227 5.2227 6.1621 6.1621 7.9353 7.9353 11.2892 11.2892 14.0947 14.0947 18.7738 18.7738 k = 0.0227-0.0186 0.0075 ( 4483 PWs) bands (ev): -37.3575 -37.3575 -12.3827 -12.3827 -10.9257 -10.9257 -0.1555 -0.1555 0.8367 0.8367 2.4091 2.4091 3.4135 3.4135 3.6555 3.6555 4.2256 4.2256 4.7777 4.7777 4.8202 4.8202 5.2211 5.2211 6.1667 6.1667 7.9489 7.9489 11.2703 11.2703 14.0755 14.0755 18.7814 18.7814 k = 0.0152-0.0124 0.0050 ( 4485 PWs) bands (ev): -37.3575 -37.3575 -12.3858 -12.3858 -10.9262 -10.9262 -0.1603 -0.1603 0.8371 0.8371 2.4076 2.4076 3.4181 3.4181 3.6643 3.6643 4.2339 4.2339 4.7800 4.7800 4.8133 4.8133 5.2199 5.2199 6.1700 6.1700 7.9587 7.9587 11.2568 11.2568 14.0618 14.0618 18.7868 18.7868 k = 0.0076-0.0062 0.0025 ( 4484 PWs) bands (ev): -37.3576 -37.3576 -12.3876 -12.3876 -10.9265 -10.9265 -0.1632 -0.1632 0.8374 0.8374 2.4067 2.4067 3.4208 3.4208 3.6695 3.6695 4.2390 4.2390 4.7811 4.7811 4.8093 4.8093 5.2192 5.2192 6.1720 6.1720 7.9647 7.9647 11.2486 11.2486 14.0534 14.0534 18.7901 18.7901 k = 0.0000 0.0000 0.0000 ( 4485 PWs) bands (ev): -37.3576 -37.3576 -12.3882 -12.3882 -10.9266 -10.9266 -0.1641 -0.1641 0.8375 0.8375 2.4063 2.4063 3.4217 3.4217 3.6713 3.6713 4.2407 4.2407 4.7814 4.7814 4.8081 4.8081 5.2190 5.2190 6.1726 6.1726 7.9667 7.9667 11.2459 11.2459 14.0507 14.0507 18.7912 18.7912 Writing output data file LiCuO2.save init_run : 0.17s CPU 0.36s WALL ( 1 calls) electrons : 118.67s CPU 121.38s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.00s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 118.66s CPU 121.36s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.03s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.09s WALL ( 529 calls) cegterg : 106.80s CPU 108.39s WALL ( 607 calls) Called by sum_band: Called by *egterg: h_psi : 65.54s CPU 66.75s WALL ( 10834 calls) s_psi : 1.97s CPU 2.09s WALL ( 10834 calls) g_psi : 0.16s CPU 0.22s WALL ( 9698 calls) cdiaghg : 37.19s CPU 37.72s WALL ( 10227 calls) cegterg:over : 3.82s CPU 3.93s WALL ( 9698 calls) cegterg:upda : 3.18s CPU 3.25s WALL ( 9698 calls) cegterg:last : 2.20s CPU 2.15s WALL ( 1661 calls) cdiaghg:chol : 1.99s CPU 2.03s WALL ( 10227 calls) cdiaghg:inve : 0.84s CPU 0.90s WALL ( 10227 calls) cdiaghg:para : 2.28s CPU 2.27s WALL ( 20454 calls) Called by h_psi: h_psi:vloc : 60.21s CPU 61.32s WALL ( 10834 calls) h_psi:vnl : 5.20s CPU 5.28s WALL ( 10834 calls) add_vuspsi : 2.50s CPU 2.51s WALL ( 10834 calls) General routines calbec : 2.66s CPU 2.74s WALL ( 10834 calls) fft : 0.00s CPU 0.00s WALL ( 15 calls) fftw : 56.95s CPU 58.13s WALL ( 721844 calls) davcio : 0.22s CPU 0.25s WALL ( 1058 calls) Parallel routines fft_scatter : 19.84s CPU 20.64s WALL ( 721859 calls) PWSCF : 2m17.28s CPU 2m48.66s WALL This run was terminated on: 17:59:44 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=