Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:11:57 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: ./CuH2C2BrN.save/ file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized 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 69 42 12 3637 1730 266 Max 70 43 13 3644 1750 270 Sum 2507 1531 435 131059 62689 9633 bravais-lattice index = 14 lattice parameter (alat) = 7.3711 a.u. unit-cell volume = 1312.4885 (a.u.)^3 number of atoms/cell = 14 number of atomic types = 5 number of electrons = 66.00 number of Kohn-Sham states= 80 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.371065 celldm(2)= 1.776137 celldm(3)= 1.981926 celldm(4)= -0.303917 celldm(5)= -0.163774 celldm(6)= -0.078929 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.140188 1.770596 0.000000 ) a(3) = ( -0.324587 -0.629925 1.850910 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.079176 0.202312 ) b(2) = ( 0.000000 0.564782 0.192214 ) b(3) = ( 0.000000 0.000000 0.540275 ) PseudoPot. # 1 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Br read from file: /users/gautes/Pseudo/Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5d639767687de88634f0d235e6526498 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1213 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 PseudoPot. # 4 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 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. # 5 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 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 atomic species valence mass pseudopotential H 1.00 1.00790 H( 1.00) Br 7.00 79.90400 Br( 1.00) Cu 11.00 63.54600 Cu( 1.00) C 4.00 12.01070 C( 1.00) N 5.00 14.00670 N( 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= 260 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 -0.2823908 -0.0961068), wk = 0.0038462 k( 2) = ( 0.0000000 -0.2710952 -0.0922625), wk = 0.0038462 k( 3) = ( 0.0000000 -0.2597995 -0.0884182), wk = 0.0038462 k( 4) = ( 0.0000000 -0.2485039 -0.0845740), wk = 0.0038462 k( 5) = ( 0.0000000 -0.2372083 -0.0807297), wk = 0.0038462 k( 6) = ( 0.0000000 -0.2259126 -0.0768854), wk = 0.0038462 k( 7) = ( 0.0000000 -0.2146170 -0.0730411), wk = 0.0038462 k( 8) = ( 0.0000000 -0.2033214 -0.0691969), wk = 0.0038462 k( 9) = ( 0.0000000 -0.1920257 -0.0653526), wk = 0.0038462 k( 10) = ( 0.0000000 -0.1807301 -0.0615083), wk = 0.0038462 k( 11) = ( 0.0000000 -0.1694345 -0.0576641), wk = 0.0038462 k( 12) = ( 0.0000000 -0.1581389 -0.0538198), wk = 0.0038462 k( 13) = ( 0.0000000 -0.1468432 -0.0499755), wk = 0.0038462 k( 14) = ( 0.0000000 -0.1355476 -0.0461312), wk = 0.0038462 k( 15) = ( 0.0000000 -0.1242520 -0.0422870), wk = 0.0038462 k( 16) = ( 0.0000000 -0.1129563 -0.0384427), wk = 0.0038462 k( 17) = ( 0.0000000 -0.1016607 -0.0345984), wk = 0.0038462 k( 18) = ( 0.0000000 -0.0903651 -0.0307542), wk = 0.0038462 k( 19) = ( 0.0000000 -0.0790694 -0.0269099), wk = 0.0038462 k( 20) = ( 0.0000000 -0.0677738 -0.0230656), wk = 0.0038462 k( 21) = ( 0.0000000 -0.0564782 -0.0192214), wk = 0.0038462 k( 22) = ( 0.0000000 -0.0451825 -0.0153771), wk = 0.0038462 k( 23) = ( 0.0000000 -0.0338869 -0.0115328), wk = 0.0038462 k( 24) = ( 0.0000000 -0.0225913 -0.0076885), wk = 0.0038462 k( 25) = ( 0.0000000 -0.0112956 -0.0038443), wk = 0.0038462 k( 26) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 27) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 28) = ( 0.0119048 0.0009426 0.0024085), wk = 0.0038462 k( 29) = ( 0.0238095 0.0018851 0.0048170), wk = 0.0038462 k( 30) = ( 0.0357143 0.0028277 0.0072254), wk = 0.0038462 k( 31) = ( 0.0476191 0.0037703 0.0096339), wk = 0.0038462 k( 32) = ( 0.0595238 0.0047129 0.0120424), wk = 0.0038462 k( 33) = ( 0.0714286 0.0056554 0.0144509), wk = 0.0038462 k( 34) = ( 0.0833333 0.0065980 0.0168594), wk = 0.0038462 k( 35) = ( 0.0952381 0.0075406 0.0192678), wk = 0.0038462 k( 36) = ( 0.1071429 0.0084831 0.0216763), wk = 0.0038462 k( 37) = ( 0.1190476 0.0094257 0.0240848), wk = 0.0038462 k( 38) = ( 0.1309524 0.0103683 0.0264933), wk = 0.0038462 k( 39) = ( 0.1428571 0.0113108 0.0289018), wk = 0.0038462 k( 40) = ( 0.1547619 0.0122534 0.0313103), wk = 0.0038462 k( 41) = ( 0.1666667 0.0131960 0.0337187), wk = 0.0038462 k( 42) = ( 0.1785714 0.0141386 0.0361272), wk = 0.0038462 k( 43) = ( 0.1904762 0.0150811 0.0385357), wk = 0.0038462 k( 44) = ( 0.2023810 0.0160237 0.0409442), wk = 0.0038462 k( 45) = ( 0.2142857 0.0169663 0.0433527), wk = 0.0038462 k( 46) = ( 0.2261905 0.0179088 0.0457611), wk = 0.0038462 k( 47) = ( 0.2380952 0.0188514 0.0481696), wk = 0.0038462 k( 48) = ( 0.2500000 0.0197940 0.0505781), wk = 0.0038462 k( 49) = ( 0.2619048 0.0207365 0.0529866), wk = 0.0038462 k( 50) = ( 0.2738095 0.0216791 0.0553951), wk = 0.0038462 k( 51) = ( 0.2857143 0.0226217 0.0578035), wk = 0.0038462 k( 52) = ( 0.2976190 0.0235643 0.0602120), wk = 0.0038462 k( 53) = ( 0.3095238 0.0245068 0.0626205), wk = 0.0038462 k( 54) = ( 0.3214286 0.0254494 0.0650290), wk = 0.0038462 k( 55) = ( 0.3333333 0.0263920 0.0674375), wk = 0.0038462 k( 56) = ( 0.3452381 0.0273345 0.0698460), wk = 0.0038462 k( 57) = ( 0.3571429 0.0282771 0.0722544), wk = 0.0038462 k( 58) = ( 0.3690476 0.0292197 0.0746629), wk = 0.0038462 k( 59) = ( 0.3809524 0.0301622 0.0770714), wk = 0.0038462 k( 60) = ( 0.3928571 0.0311048 0.0794799), wk = 0.0038462 k( 61) = ( 0.4047619 0.0320474 0.0818884), wk = 0.0038462 k( 62) = ( 0.4166667 0.0329900 0.0842968), wk = 0.0038462 k( 63) = ( 0.4285714 0.0339325 0.0867053), wk = 0.0038462 k( 64) = ( 0.4404762 0.0348751 0.0891138), wk = 0.0038462 k( 65) = ( 0.4523810 0.0358177 0.0915223), wk = 0.0038462 k( 66) = ( 0.4642857 0.0367602 0.0939308), wk = 0.0038462 k( 67) = ( 0.4761905 0.0377028 0.0963392), wk = 0.0038462 k( 68) = ( 0.4880952 0.0386454 0.0987477), wk = 0.0038462 k( 69) = ( 0.5000000 0.0395879 0.1011562), wk = 0.0038462 k( 70) = ( 0.5000000 -0.2428029 0.0050494), wk = 0.0038462 k( 71) = ( 0.4888889 -0.2374072 0.0049372), wk = 0.0038462 k( 72) = ( 0.4777778 -0.2320116 0.0048250), wk = 0.0038462 k( 73) = ( 0.4666667 -0.2266160 0.0047128), wk = 0.0038462 k( 74) = ( 0.4555556 -0.2212204 0.0046006), wk = 0.0038462 k( 75) = ( 0.4444444 -0.2158248 0.0044884), wk = 0.0038462 k( 76) = ( 0.4333333 -0.2104291 0.0043762), wk = 0.0038462 k( 77) = ( 0.4222222 -0.2050335 0.0042640), wk = 0.0038462 k( 78) = ( 0.4111111 -0.1996379 0.0041518), wk = 0.0038462 k( 79) = ( 0.4000000 -0.1942423 0.0040396), wk = 0.0038462 k( 80) = ( 0.3888889 -0.1888467 0.0039273), wk = 0.0038462 k( 81) = ( 0.3777778 -0.1834511 0.0038151), wk = 0.0038462 k( 82) = ( 0.3666667 -0.1780554 0.0037029), wk = 0.0038462 k( 83) = ( 0.3555556 -0.1726598 0.0035907), wk = 0.0038462 k( 84) = ( 0.3444444 -0.1672642 0.0034785), wk = 0.0038462 k( 85) = ( 0.3333333 -0.1618686 0.0033663), wk = 0.0038462 k( 86) = ( 0.3222222 -0.1564730 0.0032541), wk = 0.0038462 k( 87) = ( 0.3111111 -0.1510773 0.0031419), wk = 0.0038462 k( 88) = ( 0.3000000 -0.1456817 0.0030297), wk = 0.0038462 k( 89) = ( 0.2888889 -0.1402861 0.0029175), wk = 0.0038462 k( 90) = ( 0.2777778 -0.1348905 0.0028052), wk = 0.0038462 k( 91) = ( 0.2666667 -0.1294949 0.0026930), wk = 0.0038462 k( 92) = ( 0.2555556 -0.1240992 0.0025808), wk = 0.0038462 k( 93) = ( 0.2444444 -0.1187036 0.0024686), wk = 0.0038462 k( 94) = ( 0.2333333 -0.1133080 0.0023564), wk = 0.0038462 k( 95) = ( 0.2222222 -0.1079124 0.0022442), wk = 0.0038462 k( 96) = ( 0.2111111 -0.1025168 0.0021320), wk = 0.0038462 k( 97) = ( 0.2000000 -0.0971211 0.0020198), wk = 0.0038462 k( 98) = ( 0.1888889 -0.0917255 0.0019076), wk = 0.0038462 k( 99) = ( 0.1777778 -0.0863299 0.0017954), wk = 0.0038462 k( 100) = ( 0.1666667 -0.0809343 0.0016831), wk = 0.0038462 k( 101) = ( 0.1555556 -0.0755387 0.0015709), wk = 0.0038462 k( 102) = ( 0.1444444 -0.0701430 0.0014587), wk = 0.0038462 k( 103) = ( 0.1333333 -0.0647474 0.0013465), wk = 0.0038462 k( 104) = ( 0.1222222 -0.0593518 0.0012343), wk = 0.0038462 k( 105) = ( 0.1111111 -0.0539562 0.0011221), wk = 0.0038462 k( 106) = ( 0.1000000 -0.0485606 0.0010099), wk = 0.0038462 k( 107) = ( 0.0888889 -0.0431650 0.0008977), wk = 0.0038462 k( 108) = ( 0.0777778 -0.0377693 0.0007855), wk = 0.0038462 k( 109) = ( 0.0666667 -0.0323737 0.0006733), wk = 0.0038462 k( 110) = ( 0.0555556 -0.0269781 0.0005610), wk = 0.0038462 k( 111) = ( 0.0444444 -0.0215825 0.0004488), wk = 0.0038462 k( 112) = ( 0.0333333 -0.0161869 0.0003366), wk = 0.0038462 k( 113) = ( 0.0222222 -0.0107912 0.0002244), wk = 0.0038462 k( 114) = ( 0.0111111 -0.0053956 0.0001122), wk = 0.0038462 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 117) = ( -0.0116279 -0.0009207 0.0039298), wk = 0.0038462 k( 118) = ( -0.0232558 -0.0018413 0.0078596), wk = 0.0038462 k( 119) = ( -0.0348837 -0.0027619 0.0117894), wk = 0.0038462 k( 120) = ( -0.0465116 -0.0036826 0.0157192), wk = 0.0038462 k( 121) = ( -0.0581395 -0.0046032 0.0196490), wk = 0.0038462 k( 122) = ( -0.0697674 -0.0055239 0.0235788), wk = 0.0038462 k( 123) = ( -0.0813954 -0.0064445 0.0275086), wk = 0.0038462 k( 124) = ( -0.0930233 -0.0073652 0.0314384), wk = 0.0038462 k( 125) = ( -0.1046512 -0.0082858 0.0353682), wk = 0.0038462 k( 126) = ( -0.1162791 -0.0092065 0.0392979), wk = 0.0038462 k( 127) = ( -0.1279070 -0.0101271 0.0432277), wk = 0.0038462 k( 128) = ( -0.1395349 -0.0110478 0.0471575), wk = 0.0038462 k( 129) = ( -0.1511628 -0.0119684 0.0510873), wk = 0.0038462 k( 130) = ( -0.1627907 -0.0128891 0.0550171), wk = 0.0038462 k( 131) = ( -0.1744186 -0.0138097 0.0589469), wk = 0.0038462 k( 132) = ( -0.1860465 -0.0147304 0.0628767), wk = 0.0038462 k( 133) = ( -0.1976744 -0.0156510 0.0668065), wk = 0.0038462 k( 134) = ( -0.2093023 -0.0165717 0.0707363), wk = 0.0038462 k( 135) = ( -0.2209302 -0.0174923 0.0746661), wk = 0.0038462 k( 136) = ( -0.2325581 -0.0184130 0.0785959), wk = 0.0038462 k( 137) = ( -0.2441860 -0.0193336 0.0825257), wk = 0.0038462 k( 138) = ( -0.2558140 -0.0202543 0.0864555), wk = 0.0038462 k( 139) = ( -0.2674419 -0.0211749 0.0903853), wk = 0.0038462 k( 140) = ( -0.2790698 -0.0220956 0.0943151), wk = 0.0038462 k( 141) = ( -0.2906977 -0.0230162 0.0982449), wk = 0.0038462 k( 142) = ( -0.3023256 -0.0239369 0.1021747), wk = 0.0038462 k( 143) = ( -0.3139535 -0.0248575 0.1061045), wk = 0.0038462 k( 144) = ( -0.3255814 -0.0257782 0.1100343), wk = 0.0038462 k( 145) = ( -0.3372093 -0.0266988 0.1139641), wk = 0.0038462 k( 146) = ( -0.3488372 -0.0276195 0.1178938), wk = 0.0038462 k( 147) = ( -0.3604651 -0.0285401 0.1218236), wk = 0.0038462 k( 148) = ( -0.3720930 -0.0294608 0.1257534), wk = 0.0038462 k( 149) = ( -0.3837209 -0.0303814 0.1296832), wk = 0.0038462 k( 150) = ( -0.3953488 -0.0313021 0.1336130), wk = 0.0038462 k( 151) = ( -0.4069767 -0.0322227 0.1375428), wk = 0.0038462 k( 152) = ( -0.4186047 -0.0331434 0.1414726), wk = 0.0038462 k( 153) = ( -0.4302326 -0.0340640 0.1454024), wk = 0.0038462 k( 154) = ( -0.4418605 -0.0349847 0.1493322), wk = 0.0038462 k( 155) = ( -0.4534884 -0.0359053 0.1532620), wk = 0.0038462 k( 156) = ( -0.4651163 -0.0368260 0.1571918), wk = 0.0038462 k( 157) = ( -0.4767442 -0.0377466 0.1611216), wk = 0.0038462 k( 158) = ( -0.4883721 -0.0386673 0.1650514), wk = 0.0038462 k( 159) = ( -0.5000000 -0.0395879 0.1689812), wk = 0.0038462 k( 160) = ( -0.5000000 -0.3219787 0.0728744), wk = 0.0038462 k( 161) = ( -0.4897959 -0.3154078 0.0713872), wk = 0.0038462 k( 162) = ( -0.4795918 -0.3088368 0.0699000), wk = 0.0038462 k( 163) = ( -0.4693878 -0.3022658 0.0684127), wk = 0.0038462 k( 164) = ( -0.4591837 -0.2956948 0.0669255), wk = 0.0038462 k( 165) = ( -0.4489796 -0.2891238 0.0654383), wk = 0.0038462 k( 166) = ( -0.4387755 -0.2825528 0.0639510), wk = 0.0038462 k( 167) = ( -0.4285714 -0.2759818 0.0624638), wk = 0.0038462 k( 168) = ( -0.4183674 -0.2694108 0.0609766), wk = 0.0038462 k( 169) = ( -0.4081633 -0.2628398 0.0594893), wk = 0.0038462 k( 170) = ( -0.3979592 -0.2562688 0.0580021), wk = 0.0038462 k( 171) = ( -0.3877551 -0.2496978 0.0565149), wk = 0.0038462 k( 172) = ( -0.3775510 -0.2431268 0.0550276), wk = 0.0038462 k( 173) = ( -0.3673469 -0.2365558 0.0535404), wk = 0.0038462 k( 174) = ( -0.3571429 -0.2299848 0.0520532), wk = 0.0038462 k( 175) = ( -0.3469388 -0.2234138 0.0505659), wk = 0.0038462 k( 176) = ( -0.3367347 -0.2168428 0.0490787), wk = 0.0038462 k( 177) = ( -0.3265306 -0.2102718 0.0475915), wk = 0.0038462 k( 178) = ( -0.3163265 -0.2037008 0.0461042), wk = 0.0038462 k( 179) = ( -0.3061224 -0.1971298 0.0446170), wk = 0.0038462 k( 180) = ( -0.2959184 -0.1905589 0.0431298), wk = 0.0038462 k( 181) = ( -0.2857143 -0.1839879 0.0416425), wk = 0.0038462 k( 182) = ( -0.2755102 -0.1774169 0.0401553), wk = 0.0038462 k( 183) = ( -0.2653061 -0.1708459 0.0386681), wk = 0.0038462 k( 184) = ( -0.2551020 -0.1642749 0.0371808), wk = 0.0038462 k( 185) = ( -0.2448980 -0.1577039 0.0356936), wk = 0.0038462 k( 186) = ( -0.2346939 -0.1511329 0.0342064), wk = 0.0038462 k( 187) = ( -0.2244898 -0.1445619 0.0327191), wk = 0.0038462 k( 188) = ( -0.2142857 -0.1379909 0.0312319), wk = 0.0038462 k( 189) = ( -0.2040816 -0.1314199 0.0297447), wk = 0.0038462 k( 190) = ( -0.1938776 -0.1248489 0.0282574), wk = 0.0038462 k( 191) = ( -0.1836735 -0.1182779 0.0267702), wk = 0.0038462 k( 192) = ( -0.1734694 -0.1117069 0.0252830), wk = 0.0038462 k( 193) = ( -0.1632653 -0.1051359 0.0237957), wk = 0.0038462 k( 194) = ( -0.1530612 -0.0985649 0.0223085), wk = 0.0038462 k( 195) = ( -0.1428571 -0.0919939 0.0208213), wk = 0.0038462 k( 196) = ( -0.1326531 -0.0854229 0.0193340), wk = 0.0038462 k( 197) = ( -0.1224490 -0.0788519 0.0178468), wk = 0.0038462 k( 198) = ( -0.1122449 -0.0722809 0.0163596), wk = 0.0038462 k( 199) = ( -0.1020408 -0.0657100 0.0148723), wk = 0.0038462 k( 200) = ( -0.0918367 -0.0591390 0.0133851), wk = 0.0038462 k( 201) = ( -0.0816327 -0.0525680 0.0118979), wk = 0.0038462 k( 202) = ( -0.0714286 -0.0459970 0.0104106), wk = 0.0038462 k( 203) = ( -0.0612245 -0.0394260 0.0089234), wk = 0.0038462 k( 204) = ( -0.0510204 -0.0328550 0.0074362), wk = 0.0038462 k( 205) = ( -0.0408163 -0.0262840 0.0059489), wk = 0.0038462 k( 206) = ( -0.0306122 -0.0197130 0.0044617), wk = 0.0038462 k( 207) = ( -0.0204082 -0.0131420 0.0029745), wk = 0.0038462 k( 208) = ( -0.0102041 -0.0065710 0.0014872), wk = 0.0038462 k( 209) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 210) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 211) = ( 0.0000000 0.0000000 0.0122790), wk = 0.0038462 k( 212) = ( 0.0000000 0.0000000 0.0245579), wk = 0.0038462 k( 213) = ( 0.0000000 0.0000000 0.0368369), wk = 0.0038462 k( 214) = ( 0.0000000 0.0000000 0.0491159), wk = 0.0038462 k( 215) = ( 0.0000000 0.0000000 0.0613949), wk = 0.0038462 k( 216) = ( 0.0000000 0.0000000 0.0736738), wk = 0.0038462 k( 217) = ( 0.0000000 0.0000000 0.0859528), wk = 0.0038462 k( 218) = ( 0.0000000 0.0000000 0.0982318), wk = 0.0038462 k( 219) = ( 0.0000000 0.0000000 0.1105107), wk = 0.0038462 k( 220) = ( 0.0000000 0.0000000 0.1227897), wk = 0.0038462 k( 221) = ( 0.0000000 0.0000000 0.1350687), wk = 0.0038462 k( 222) = ( 0.0000000 0.0000000 0.1473477), wk = 0.0038462 k( 223) = ( 0.0000000 0.0000000 0.1596266), wk = 0.0038462 k( 224) = ( 0.0000000 0.0000000 0.1719056), wk = 0.0038462 k( 225) = ( 0.0000000 0.0000000 0.1841846), wk = 0.0038462 k( 226) = ( 0.0000000 0.0000000 0.1964636), wk = 0.0038462 k( 227) = ( 0.0000000 0.0000000 0.2087425), wk = 0.0038462 k( 228) = ( 0.0000000 0.0000000 0.2210215), wk = 0.0038462 k( 229) = ( 0.0000000 0.0000000 0.2333005), wk = 0.0038462 k( 230) = ( 0.0000000 0.0000000 0.2455794), wk = 0.0038462 k( 231) = ( 0.0000000 0.0000000 0.2578584), wk = 0.0038462 k( 232) = ( 0.0000000 0.0000000 0.2701374), wk = 0.0038462 k( 233) = ( 0.0000000 -0.2823908 0.1740306), wk = 0.0038462 k( 234) = ( 0.0000000 -0.2719319 0.1675850), wk = 0.0038462 k( 235) = ( 0.0000000 -0.2614730 0.1611395), wk = 0.0038462 k( 236) = ( 0.0000000 -0.2510140 0.1546939), wk = 0.0038462 k( 237) = ( 0.0000000 -0.2405551 0.1482483), wk = 0.0038462 k( 238) = ( 0.0000000 -0.2300962 0.1418027), wk = 0.0038462 k( 239) = ( 0.0000000 -0.2196373 0.1353572), wk = 0.0038462 k( 240) = ( 0.0000000 -0.2091784 0.1289116), wk = 0.0038462 k( 241) = ( 0.0000000 -0.1987195 0.1224660), wk = 0.0038462 k( 242) = ( 0.0000000 -0.1882605 0.1160204), wk = 0.0038462 k( 243) = ( 0.0000000 -0.1778016 0.1095748), wk = 0.0038462 k( 244) = ( 0.0000000 -0.1673427 0.1031293), wk = 0.0038462 k( 245) = ( 0.0000000 -0.1568838 0.0966837), wk = 0.0038462 k( 246) = ( 0.0000000 -0.1464249 0.0902381), wk = 0.0038462 k( 247) = ( 0.0000000 -0.1359659 0.0837925), wk = 0.0038462 k( 248) = ( 0.0000000 -0.1255070 0.0773469), wk = 0.0038462 k( 249) = ( 0.0000000 -0.1150481 0.0709014), wk = 0.0038462 k( 250) = ( 0.0000000 -0.1045892 0.0644558), wk = 0.0038462 k( 251) = ( 0.0000000 -0.0941303 0.0580102), wk = 0.0038462 k( 252) = ( 0.0000000 -0.0836714 0.0515646), wk = 0.0038462 k( 253) = ( 0.0000000 -0.0732124 0.0451191), wk = 0.0038462 k( 254) = ( 0.0000000 -0.0627535 0.0386735), wk = 0.0038462 k( 255) = ( 0.0000000 -0.0522946 0.0322279), wk = 0.0038462 k( 256) = ( 0.0000000 -0.0418357 0.0257823), wk = 0.0038462 k( 257) = ( 0.0000000 -0.0313768 0.0193367), wk = 0.0038462 k( 258) = ( 0.0000000 -0.0209178 0.0128912), wk = 0.0038462 k( 259) = ( 0.0000000 -0.0104589 0.0064456), wk = 0.0038462 k( 260) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 cryst. coord. k( 1) = ( 0.0000000 -0.5000000 -0.0000000), wk = 0.0038462 k( 2) = ( 0.0000000 -0.4800000 -0.0000000), wk = 0.0038462 k( 3) = ( 0.0000000 -0.4600000 -0.0000000), wk = 0.0038462 k( 4) = ( 0.0000000 -0.4400000 -0.0000000), wk = 0.0038462 k( 5) = ( 0.0000000 -0.4200000 -0.0000000), wk = 0.0038462 k( 6) = ( 0.0000000 -0.4000000 -0.0000000), wk = 0.0038462 k( 7) = ( 0.0000000 -0.3800000 -0.0000000), wk = 0.0038462 k( 8) = ( 0.0000000 -0.3600000 -0.0000000), wk = 0.0038462 k( 9) = ( 0.0000000 -0.3400000 -0.0000000), wk = 0.0038462 k( 10) = ( 0.0000000 -0.3200000 -0.0000000), wk = 0.0038462 k( 11) = ( 0.0000000 -0.3000000 -0.0000000), wk = 0.0038462 k( 12) = ( 0.0000000 -0.2800000 -0.0000000), wk = 0.0038462 k( 13) = ( 0.0000000 -0.2600000 -0.0000000), wk = 0.0038462 k( 14) = ( 0.0000000 -0.2400000 -0.0000000), wk = 0.0038462 k( 15) = ( 0.0000000 -0.2200000 -0.0000000), wk = 0.0038462 k( 16) = ( 0.0000000 -0.2000000 -0.0000000), wk = 0.0038462 k( 17) = ( 0.0000000 -0.1800000 -0.0000000), wk = 0.0038462 k( 18) = ( 0.0000000 -0.1600000 -0.0000000), wk = 0.0038462 k( 19) = ( 0.0000000 -0.1400000 -0.0000000), wk = 0.0038462 k( 20) = ( 0.0000000 -0.1200000 -0.0000000), wk = 0.0038462 k( 21) = ( 0.0000000 -0.1000000 -0.0000000), wk = 0.0038462 k( 22) = ( 0.0000000 -0.0800000 -0.0000000), wk = 0.0038462 k( 23) = ( 0.0000000 -0.0600000 -0.0000000), wk = 0.0038462 k( 24) = ( 0.0000000 -0.0400000 -0.0000000), wk = 0.0038462 k( 25) = ( 0.0000000 -0.0200000 -0.0000000), wk = 0.0038462 k( 26) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 27) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 28) = ( 0.0119048 0.0000000 0.0000000), wk = 0.0038462 k( 29) = ( 0.0238095 0.0000000 0.0000000), wk = 0.0038462 k( 30) = ( 0.0357143 0.0000000 0.0000000), wk = 0.0038462 k( 31) = ( 0.0476191 0.0000000 0.0000000), wk = 0.0038462 k( 32) = ( 0.0595238 0.0000000 0.0000000), wk = 0.0038462 k( 33) = ( 0.0714286 0.0000000 0.0000000), wk = 0.0038462 k( 34) = ( 0.0833333 -0.0000000 0.0000000), wk = 0.0038462 k( 35) = ( 0.0952381 0.0000000 0.0000000), wk = 0.0038462 k( 36) = ( 0.1071429 0.0000000 -0.0000000), wk = 0.0038462 k( 37) = ( 0.1190476 0.0000000 0.0000000), wk = 0.0038462 k( 38) = ( 0.1309524 0.0000000 -0.0000000), wk = 0.0038462 k( 39) = ( 0.1428571 0.0000000 0.0000000), wk = 0.0038462 k( 40) = ( 0.1547619 0.0000000 -0.0000000), wk = 0.0038462 k( 41) = ( 0.1666667 0.0000000 -0.0000000), wk = 0.0038462 k( 42) = ( 0.1785714 0.0000000 0.0000000), wk = 0.0038462 k( 43) = ( 0.1904762 0.0000000 -0.0000000), wk = 0.0038462 k( 44) = ( 0.2023810 -0.0000000 0.0000000), wk = 0.0038462 k( 45) = ( 0.2142857 0.0000000 -0.0000000), wk = 0.0038462 k( 46) = ( 0.2261905 0.0000000 -0.0000000), wk = 0.0038462 k( 47) = ( 0.2380952 0.0000000 0.0000000), wk = 0.0038462 k( 48) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0038462 k( 49) = ( 0.2619048 0.0000000 -0.0000000), wk = 0.0038462 k( 50) = ( 0.2738095 0.0000000 0.0000000), wk = 0.0038462 k( 51) = ( 0.2857143 -0.0000000 -0.0000000), wk = 0.0038462 k( 52) = ( 0.2976190 0.0000000 -0.0000000), wk = 0.0038462 k( 53) = ( 0.3095238 0.0000000 -0.0000000), wk = 0.0038462 k( 54) = ( 0.3214286 0.0000000 -0.0000000), wk = 0.0038462 k( 55) = ( 0.3333333 0.0000000 -0.0000000), wk = 0.0038462 k( 56) = ( 0.3452381 0.0000000 -0.0000000), wk = 0.0038462 k( 57) = ( 0.3571429 0.0000000 0.0000000), wk = 0.0038462 k( 58) = ( 0.3690476 0.0000000 -0.0000000), wk = 0.0038462 k( 59) = ( 0.3809524 0.0000000 -0.0000000), wk = 0.0038462 k( 60) = ( 0.3928571 0.0000000 0.0000000), wk = 0.0038462 k( 61) = ( 0.4047619 -0.0000000 0.0000000), wk = 0.0038462 k( 62) = ( 0.4166667 0.0000000 0.0000000), wk = 0.0038462 k( 63) = ( 0.4285714 0.0000000 0.0000000), wk = 0.0038462 k( 64) = ( 0.4404762 0.0000000 -0.0000000), wk = 0.0038462 k( 65) = ( 0.4523810 -0.0000000 0.0000000), wk = 0.0038462 k( 66) = ( 0.4642857 0.0000000 0.0000000), wk = 0.0038462 k( 67) = ( 0.4761905 0.0000000 0.0000000), wk = 0.0038462 k( 68) = ( 0.4880952 0.0000000 0.0000000), wk = 0.0038462 k( 69) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0038462 k( 70) = ( 0.5000000 -0.5000000 -0.0000000), wk = 0.0038462 k( 71) = ( 0.4888889 -0.4888889 -0.0000000), wk = 0.0038462 k( 72) = ( 0.4777778 -0.4777778 -0.0000000), wk = 0.0038462 k( 73) = ( 0.4666667 -0.4666667 -0.0000000), wk = 0.0038462 k( 74) = ( 0.4555556 -0.4555556 -0.0000000), wk = 0.0038462 k( 75) = ( 0.4444444 -0.4444444 -0.0000000), wk = 0.0038462 k( 76) = ( 0.4333333 -0.4333333 -0.0000000), wk = 0.0038462 k( 77) = ( 0.4222222 -0.4222222 -0.0000000), wk = 0.0038462 k( 78) = ( 0.4111111 -0.4111111 -0.0000000), wk = 0.0038462 k( 79) = ( 0.4000000 -0.4000000 -0.0000000), wk = 0.0038462 k( 80) = ( 0.3888889 -0.3888889 -0.0000000), wk = 0.0038462 k( 81) = ( 0.3777778 -0.3777778 -0.0000000), wk = 0.0038462 k( 82) = ( 0.3666667 -0.3666667 -0.0000000), wk = 0.0038462 k( 83) = ( 0.3555556 -0.3555556 -0.0000000), wk = 0.0038462 k( 84) = ( 0.3444444 -0.3444444 -0.0000000), wk = 0.0038462 k( 85) = ( 0.3333333 -0.3333333 -0.0000000), wk = 0.0038462 k( 86) = ( 0.3222222 -0.3222222 -0.0000000), wk = 0.0038462 k( 87) = ( 0.3111111 -0.3111111 -0.0000000), wk = 0.0038462 k( 88) = ( 0.3000000 -0.3000000 -0.0000000), wk = 0.0038462 k( 89) = ( 0.2888889 -0.2888889 -0.0000000), wk = 0.0038462 k( 90) = ( 0.2777778 -0.2777778 -0.0000000), wk = 0.0038462 k( 91) = ( 0.2666667 -0.2666667 -0.0000000), wk = 0.0038462 k( 92) = ( 0.2555556 -0.2555556 -0.0000000), wk = 0.0038462 k( 93) = ( 0.2444444 -0.2444444 -0.0000000), wk = 0.0038462 k( 94) = ( 0.2333333 -0.2333333 -0.0000000), wk = 0.0038462 k( 95) = ( 0.2222222 -0.2222222 -0.0000000), wk = 0.0038462 k( 96) = ( 0.2111111 -0.2111111 -0.0000000), wk = 0.0038462 k( 97) = ( 0.2000000 -0.2000000 -0.0000000), wk = 0.0038462 k( 98) = ( 0.1888889 -0.1888889 -0.0000000), wk = 0.0038462 k( 99) = ( 0.1777778 -0.1777778 -0.0000000), wk = 0.0038462 k( 100) = ( 0.1666667 -0.1666667 -0.0000000), wk = 0.0038462 k( 101) = ( 0.1555556 -0.1555556 -0.0000000), wk = 0.0038462 k( 102) = ( 0.1444444 -0.1444444 -0.0000000), wk = 0.0038462 k( 103) = ( 0.1333333 -0.1333333 -0.0000000), wk = 0.0038462 k( 104) = ( 0.1222222 -0.1222222 -0.0000000), wk = 0.0038462 k( 105) = ( 0.1111111 -0.1111111 -0.0000000), wk = 0.0038462 k( 106) = ( 0.1000000 -0.1000000 -0.0000000), wk = 0.0038462 k( 107) = ( 0.0888889 -0.0888889 -0.0000000), wk = 0.0038462 k( 108) = ( 0.0777778 -0.0777778 -0.0000000), wk = 0.0038462 k( 109) = ( 0.0666667 -0.0666667 -0.0000000), wk = 0.0038462 k( 110) = ( 0.0555556 -0.0555556 -0.0000000), wk = 0.0038462 k( 111) = ( 0.0444444 -0.0444444 0.0000000), wk = 0.0038462 k( 112) = ( 0.0333333 -0.0333333 -0.0000000), wk = 0.0038462 k( 113) = ( 0.0222222 -0.0222222 0.0000000), wk = 0.0038462 k( 114) = ( 0.0111111 -0.0111111 0.0000000), wk = 0.0038462 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 117) = ( -0.0116279 -0.0000000 0.0116279), wk = 0.0038462 k( 118) = ( -0.0232558 0.0000000 0.0232558), wk = 0.0038462 k( 119) = ( -0.0348837 -0.0000000 0.0348837), wk = 0.0038462 k( 120) = ( -0.0465116 -0.0000000 0.0465116), wk = 0.0038462 k( 121) = ( -0.0581395 -0.0000000 0.0581395), wk = 0.0038462 k( 122) = ( -0.0697674 -0.0000000 0.0697674), wk = 0.0038462 k( 123) = ( -0.0813954 -0.0000000 0.0813954), wk = 0.0038462 k( 124) = ( -0.0930233 -0.0000000 0.0930233), wk = 0.0038462 k( 125) = ( -0.1046512 -0.0000000 0.1046512), wk = 0.0038462 k( 126) = ( -0.1162791 -0.0000000 0.1162791), wk = 0.0038462 k( 127) = ( -0.1279070 -0.0000000 0.1279070), wk = 0.0038462 k( 128) = ( -0.1395349 -0.0000000 0.1395349), wk = 0.0038462 k( 129) = ( -0.1511628 0.0000000 0.1511628), wk = 0.0038462 k( 130) = ( -0.1627907 -0.0000000 0.1627907), wk = 0.0038462 k( 131) = ( -0.1744186 -0.0000000 0.1744186), wk = 0.0038462 k( 132) = ( -0.1860465 -0.0000000 0.1860465), wk = 0.0038462 k( 133) = ( -0.1976744 -0.0000000 0.1976744), wk = 0.0038462 k( 134) = ( -0.2093023 -0.0000000 0.2093023), wk = 0.0038462 k( 135) = ( -0.2209302 -0.0000000 0.2209302), wk = 0.0038462 k( 136) = ( -0.2325581 -0.0000000 0.2325581), wk = 0.0038462 k( 137) = ( -0.2441860 -0.0000000 0.2441860), wk = 0.0038462 k( 138) = ( -0.2558140 -0.0000000 0.2558140), wk = 0.0038462 k( 139) = ( -0.2674419 -0.0000000 0.2674419), wk = 0.0038462 k( 140) = ( -0.2790698 -0.0000000 0.2790698), wk = 0.0038462 k( 141) = ( -0.2906977 0.0000000 0.2906977), wk = 0.0038462 k( 142) = ( -0.3023256 0.0000000 0.3023256), wk = 0.0038462 k( 143) = ( -0.3139535 -0.0000000 0.3139535), wk = 0.0038462 k( 144) = ( -0.3255814 -0.0000000 0.3255814), wk = 0.0038462 k( 145) = ( -0.3372093 -0.0000000 0.3372093), wk = 0.0038462 k( 146) = ( -0.3488372 -0.0000000 0.3488372), wk = 0.0038462 k( 147) = ( -0.3604651 -0.0000000 0.3604651), wk = 0.0038462 k( 148) = ( -0.3720930 -0.0000000 0.3720930), wk = 0.0038462 k( 149) = ( -0.3837209 -0.0000000 0.3837209), wk = 0.0038462 k( 150) = ( -0.3953488 -0.0000000 0.3953488), wk = 0.0038462 k( 151) = ( -0.4069767 0.0000000 0.4069767), wk = 0.0038462 k( 152) = ( -0.4186047 -0.0000000 0.4186046), wk = 0.0038462 k( 153) = ( -0.4302326 -0.0000000 0.4302326), wk = 0.0038462 k( 154) = ( -0.4418605 -0.0000000 0.4418605), wk = 0.0038462 k( 155) = ( -0.4534884 -0.0000000 0.4534884), wk = 0.0038462 k( 156) = ( -0.4651163 -0.0000000 0.4651163), wk = 0.0038462 k( 157) = ( -0.4767442 -0.0000000 0.4767442), wk = 0.0038462 k( 158) = ( -0.4883721 -0.0000000 0.4883721), wk = 0.0038462 k( 159) = ( -0.5000000 0.0000000 0.5000000), wk = 0.0038462 k( 160) = ( -0.5000000 -0.5000000 0.5000000), wk = 0.0038462 k( 161) = ( -0.4897959 -0.4897959 0.4897959), wk = 0.0038462 k( 162) = ( -0.4795918 -0.4795918 0.4795918), wk = 0.0038462 k( 163) = ( -0.4693878 -0.4693878 0.4693878), wk = 0.0038462 k( 164) = ( -0.4591837 -0.4591837 0.4591837), wk = 0.0038462 k( 165) = ( -0.4489796 -0.4489796 0.4489796), wk = 0.0038462 k( 166) = ( -0.4387755 -0.4387755 0.4387755), wk = 0.0038462 k( 167) = ( -0.4285714 -0.4285714 0.4285714), wk = 0.0038462 k( 168) = ( -0.4183674 -0.4183674 0.4183674), wk = 0.0038462 k( 169) = ( -0.4081633 -0.4081633 0.4081633), wk = 0.0038462 k( 170) = ( -0.3979592 -0.3979592 0.3979592), wk = 0.0038462 k( 171) = ( -0.3877551 -0.3877551 0.3877551), wk = 0.0038462 k( 172) = ( -0.3775510 -0.3775510 0.3775510), wk = 0.0038462 k( 173) = ( -0.3673469 -0.3673469 0.3673469), wk = 0.0038462 k( 174) = ( -0.3571429 -0.3571429 0.3571429), wk = 0.0038462 k( 175) = ( -0.3469388 -0.3469388 0.3469388), wk = 0.0038462 k( 176) = ( -0.3367347 -0.3367347 0.3367347), wk = 0.0038462 k( 177) = ( -0.3265306 -0.3265306 0.3265306), wk = 0.0038462 k( 178) = ( -0.3163265 -0.3163265 0.3163265), wk = 0.0038462 k( 179) = ( -0.3061224 -0.3061224 0.3061224), wk = 0.0038462 k( 180) = ( -0.2959184 -0.2959184 0.2959184), wk = 0.0038462 k( 181) = ( -0.2857143 -0.2857143 0.2857143), wk = 0.0038462 k( 182) = ( -0.2755102 -0.2755102 0.2755102), wk = 0.0038462 k( 183) = ( -0.2653061 -0.2653061 0.2653061), wk = 0.0038462 k( 184) = ( -0.2551020 -0.2551020 0.2551020), wk = 0.0038462 k( 185) = ( -0.2448980 -0.2448980 0.2448980), wk = 0.0038462 k( 186) = ( -0.2346939 -0.2346939 0.2346939), wk = 0.0038462 k( 187) = ( -0.2244898 -0.2244898 0.2244898), wk = 0.0038462 k( 188) = ( -0.2142857 -0.2142857 0.2142857), wk = 0.0038462 k( 189) = ( -0.2040816 -0.2040816 0.2040816), wk = 0.0038462 k( 190) = ( -0.1938776 -0.1938775 0.1938775), wk = 0.0038462 k( 191) = ( -0.1836735 -0.1836735 0.1836735), wk = 0.0038462 k( 192) = ( -0.1734694 -0.1734694 0.1734694), wk = 0.0038462 k( 193) = ( -0.1632653 -0.1632653 0.1632653), wk = 0.0038462 k( 194) = ( -0.1530612 -0.1530612 0.1530612), wk = 0.0038462 k( 195) = ( -0.1428571 -0.1428571 0.1428571), wk = 0.0038462 k( 196) = ( -0.1326531 -0.1326531 0.1326531), wk = 0.0038462 k( 197) = ( -0.1224490 -0.1224490 0.1224490), wk = 0.0038462 k( 198) = ( -0.1122449 -0.1122449 0.1122449), wk = 0.0038462 k( 199) = ( -0.1020408 -0.1020408 0.1020408), wk = 0.0038462 k( 200) = ( -0.0918367 -0.0918367 0.0918367), wk = 0.0038462 k( 201) = ( -0.0816327 -0.0816327 0.0816327), wk = 0.0038462 k( 202) = ( -0.0714286 -0.0714286 0.0714286), wk = 0.0038462 k( 203) = ( -0.0612245 -0.0612245 0.0612245), wk = 0.0038462 k( 204) = ( -0.0510204 -0.0510204 0.0510204), wk = 0.0038462 k( 205) = ( -0.0408163 -0.0408163 0.0408163), wk = 0.0038462 k( 206) = ( -0.0306122 -0.0306122 0.0306122), wk = 0.0038462 k( 207) = ( -0.0204082 -0.0204082 0.0204082), wk = 0.0038462 k( 208) = ( -0.0102041 -0.0102041 0.0102041), wk = 0.0038462 k( 209) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 210) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 k( 211) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0038462 k( 212) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0038462 k( 213) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0038462 k( 214) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0038462 k( 215) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0038462 k( 216) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0038462 k( 217) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0038462 k( 218) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0038462 k( 219) = ( 0.0000000 0.0000000 0.2045454), wk = 0.0038462 k( 220) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0038462 k( 221) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0038462 k( 222) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0038462 k( 223) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0038462 k( 224) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0038462 k( 225) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0038462 k( 226) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0038462 k( 227) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0038462 k( 228) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0038462 k( 229) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0038462 k( 230) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0038462 k( 231) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0038462 k( 232) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038462 k( 233) = ( 0.0000000 -0.5000000 0.5000000), wk = 0.0038462 k( 234) = ( 0.0000000 -0.4814815 0.4814815), wk = 0.0038462 k( 235) = ( 0.0000000 -0.4629630 0.4629630), wk = 0.0038462 k( 236) = ( 0.0000000 -0.4444444 0.4444444), wk = 0.0038462 k( 237) = ( 0.0000000 -0.4259259 0.4259259), wk = 0.0038462 k( 238) = ( 0.0000000 -0.4074074 0.4074074), wk = 0.0038462 k( 239) = ( 0.0000000 -0.3888889 0.3888889), wk = 0.0038462 k( 240) = ( 0.0000000 -0.3703704 0.3703704), wk = 0.0038462 k( 241) = ( 0.0000000 -0.3518518 0.3518518), wk = 0.0038462 k( 242) = ( 0.0000000 -0.3333333 0.3333333), wk = 0.0038462 k( 243) = ( 0.0000000 -0.3148148 0.3148148), wk = 0.0038462 k( 244) = ( 0.0000000 -0.2962963 0.2962963), wk = 0.0038462 k( 245) = ( 0.0000000 -0.2777778 0.2777778), wk = 0.0038462 k( 246) = ( 0.0000000 -0.2592593 0.2592593), wk = 0.0038462 k( 247) = ( 0.0000000 -0.2407407 0.2407407), wk = 0.0038462 k( 248) = ( 0.0000000 -0.2222222 0.2222222), wk = 0.0038462 k( 249) = ( 0.0000000 -0.2037037 0.2037037), wk = 0.0038462 k( 250) = ( 0.0000000 -0.1851852 0.1851852), wk = 0.0038462 k( 251) = ( 0.0000000 -0.1666667 0.1666667), wk = 0.0038462 k( 252) = ( 0.0000000 -0.1481481 0.1481482), wk = 0.0038462 k( 253) = ( 0.0000000 -0.1296296 0.1296296), wk = 0.0038462 k( 254) = ( 0.0000000 -0.1111111 0.1111111), wk = 0.0038462 k( 255) = ( 0.0000000 -0.0925926 0.0925926), wk = 0.0038462 k( 256) = ( 0.0000000 -0.0740741 0.0740741), wk = 0.0038462 k( 257) = ( 0.0000000 -0.0555556 0.0555556), wk = 0.0038462 k( 258) = ( 0.0000000 -0.0370370 0.0370370), wk = 0.0038462 k( 259) = ( 0.0000000 -0.0185185 0.0185185), wk = 0.0038462 k( 260) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038462 Dense grid: 131059 G-vectors FFT dimensions: ( 45, 75, 90) Smooth grid: 62689 G-vectors FFT dimensions: ( 36, 60, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.54 Mb ( 442, 80) NL pseudopotentials 0.63 Mb ( 221, 188) Each V/rho on FFT grid 0.15 Mb ( 10125) Each G-vector array 0.03 Mb ( 3638) G-vector shells 0.03 Mb ( 3601) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.16 Mb ( 442, 320) Each subspace H/S matrix 0.10 Mb ( 80, 80) Each matrix 0.46 Mb ( 188, 2, 80) Check: negative/imaginary core charge= -0.000005 0.000000 The potential is recalculated from file : ./CuH2C2BrN.save/charge-density.dat Starting wfc are 108 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.0 secs Computing kpt #: 2 total cpu time spent up to now is 4.9 secs Computing kpt #: 3 total cpu time spent up to now is 5.9 secs Computing kpt #: 4 total cpu time spent up to now is 6.8 secs Computing kpt #: 5 total cpu time spent up to now is 7.7 secs Computing kpt #: 6 total cpu time spent up to now is 8.6 secs Computing kpt #: 7 total cpu time spent up to now is 9.6 secs Computing kpt #: 8 total cpu time spent up to now is 10.5 secs Computing kpt #: 9 total cpu time spent up to now is 11.4 secs Computing kpt #: 10 total cpu time spent up to now is 12.3 secs Computing kpt #: 11 total cpu time spent up to now is 13.2 secs Computing kpt #: 12 total cpu time spent up to now is 14.1 secs Computing kpt #: 13 total cpu time spent up to now is 15.0 secs Computing kpt #: 14 total cpu time spent up to now is 15.9 secs Computing kpt #: 15 total cpu time spent up to now is 16.9 secs Computing kpt #: 16 total cpu time spent up to now is 17.8 secs Computing kpt #: 17 total cpu time spent up to now is 18.8 secs Computing kpt #: 18 total cpu time spent up to now is 19.7 secs Computing kpt #: 19 total cpu time spent up to now is 20.7 secs Computing kpt #: 20 total cpu time spent up to now is 21.7 secs Computing kpt #: 21 total cpu time spent up to now is 22.6 secs Computing kpt #: 22 total cpu time spent up to now is 23.6 secs Computing kpt #: 23 total cpu time spent up to now is 24.8 secs Computing kpt #: 24 total cpu time spent up to now is 25.9 secs Computing kpt #: 25 total cpu time spent up to now is 27.0 secs Computing kpt #: 26 total cpu time spent up to now is 28.1 secs Computing kpt #: 27 total cpu time spent up to now is 29.2 secs Computing kpt #: 28 total cpu time spent up to now is 30.3 secs Computing kpt #: 29 total cpu time spent up to now is 31.4 secs Computing kpt #: 30 total cpu time spent up to now is 32.5 secs Computing kpt #: 31 total cpu time spent up to now is 33.6 secs Computing kpt #: 32 total cpu time spent up to now is 34.7 secs Computing kpt #: 33 total cpu time spent up to now is 35.8 secs Computing kpt #: 34 total cpu time spent up to now is 36.9 secs Computing kpt #: 35 total cpu time spent up to now is 39.3 secs Computing kpt #: 36 total cpu time spent up to now is 40.3 secs Computing kpt #: 37 total cpu time spent up to now is 41.2 secs Computing kpt #: 38 total cpu time spent up to now is 42.2 secs Computing kpt #: 39 total cpu time spent up to now is 43.1 secs Computing kpt #: 40 total cpu time spent up to now is 44.1 secs Computing kpt #: 41 total cpu time spent up to now is 45.0 secs Computing kpt #: 42 total cpu time spent up to now is 45.9 secs Computing kpt #: 43 total cpu time spent up to now is 46.9 secs Computing kpt #: 44 total cpu time spent up to now is 47.8 secs Computing kpt #: 45 total cpu time spent up to now is 48.8 secs Computing kpt #: 46 total cpu time spent up to now is 49.7 secs Computing kpt #: 47 total cpu time spent up to now is 50.7 secs Computing kpt #: 48 total cpu time spent up to now is 51.7 secs Computing kpt #: 49 total cpu time spent up to now is 52.6 secs Computing kpt #: 50 total cpu time spent up to now is 53.6 secs Computing kpt #: 51 total cpu time spent up to now is 54.6 secs Computing kpt #: 52 total cpu time spent up to now is 55.5 secs Computing kpt #: 53 total cpu time spent up to now is 56.5 secs Computing kpt #: 54 total cpu time spent up to now is 57.5 secs Computing kpt #: 55 total cpu time spent up to now is 58.4 secs Computing kpt #: 56 total cpu time spent up to now is 59.4 secs Computing kpt #: 57 total cpu time spent up to now is 60.3 secs Computing kpt #: 58 total cpu time spent up to now is 61.3 secs Computing kpt #: 59 total cpu time spent up to now is 62.2 secs Computing kpt #: 60 total cpu time spent up to now is 63.1 secs Computing kpt #: 61 total cpu time spent up to now is 64.1 secs Computing kpt #: 62 total cpu time spent up to now is 65.0 secs Computing kpt #: 63 total cpu time spent up to now is 65.9 secs Computing kpt #: 64 total cpu time spent up to now is 66.8 secs Computing kpt #: 65 total cpu time spent up to now is 67.7 secs Computing kpt #: 66 total cpu time spent up to now is 68.7 secs Computing kpt #: 67 total cpu time spent up to now is 69.6 secs Computing kpt #: 68 total cpu time spent up to now is 70.4 secs Computing kpt #: 69 total cpu time spent up to now is 71.3 secs Computing kpt #: 70 total cpu time spent up to now is 72.3 secs Computing kpt #: 71 total cpu time spent up to now is 73.2 secs Computing kpt #: 72 total cpu time spent up to now is 74.2 secs Computing kpt #: 73 total cpu time spent up to now is 75.1 secs Computing kpt #: 74 total cpu time spent up to now is 76.1 secs Computing kpt #: 75 total cpu time spent up to now is 77.1 secs Computing kpt #: 76 total cpu time spent up to now is 78.0 secs Computing kpt #: 77 total cpu time spent up to now is 79.1 secs Computing kpt #: 78 total cpu time spent up to now is 80.1 secs Computing kpt #: 79 total cpu time spent up to now is 81.1 secs Computing kpt #: 80 total cpu time spent up to now is 82.2 secs Computing kpt #: 81 total cpu time spent up to now is 83.3 secs Computing kpt #: 82 total cpu time spent up to now is 84.3 secs Computing kpt #: 83 total cpu time spent up to now is 85.3 secs Computing kpt #: 84 total cpu time spent up to now is 86.4 secs Computing kpt #: 85 total cpu time spent up to now is 87.4 secs Computing kpt #: 86 total cpu time spent up to now is 88.5 secs Computing kpt #: 87 total cpu time spent up to now is 89.7 secs Computing kpt #: 88 total cpu time spent up to now is 90.8 secs Computing kpt #: 89 total cpu time spent up to now is 91.9 secs Computing kpt #: 90 total cpu time spent up to now is 93.0 secs Computing kpt #: 91 total cpu time spent up to now is 94.1 secs Computing kpt #: 92 total cpu time spent up to now is 95.2 secs Computing kpt #: 93 total cpu time spent up to now is 96.2 secs Computing kpt #: 94 total cpu time spent up to now is 97.2 secs Computing kpt #: 95 total cpu time spent up to now is 98.2 secs Computing kpt #: 96 total cpu time spent up to now is 99.2 secs Computing kpt #: 97 total cpu time spent up to now is 100.2 secs Computing kpt #: 98 total cpu time spent up to now is 101.3 secs Computing kpt #: 99 total cpu time spent up to now is 102.4 secs Computing kpt #: 100 total cpu time spent up to now is 103.4 secs Computing kpt #: 101 total cpu time spent up to now is 104.4 secs Computing kpt #: 102 total cpu time spent up to now is 105.4 secs Computing kpt #: 103 total cpu time spent up to now is 106.4 secs Computing kpt #: 104 total cpu time spent up to now is 107.3 secs Computing kpt #: 105 total cpu time spent up to now is 108.3 secs Computing kpt #: 106 total cpu time spent up to now is 109.3 secs Computing kpt #: 107 total cpu time spent up to now is 110.3 secs Computing kpt #: 108 total cpu time spent up to now is 111.2 secs Computing kpt #: 109 total cpu time spent up to now is 112.4 secs Computing kpt #: 110 total cpu time spent up to now is 113.5 secs Computing kpt #: 111 total cpu time spent up to now is 114.6 secs Computing kpt #: 112 total cpu time spent up to now is 115.7 secs Computing kpt #: 113 total cpu time spent up to now is 116.8 secs Computing kpt #: 114 total cpu time spent up to now is 117.9 secs Computing kpt #: 115 total cpu time spent up to now is 119.0 secs Computing kpt #: 116 total cpu time spent up to now is 120.1 secs Computing kpt #: 117 total cpu time spent up to now is 121.2 secs Computing kpt #: 118 total cpu time spent up to now is 122.3 secs Computing kpt #: 119 total cpu time spent up to now is 123.4 secs Computing kpt #: 120 total cpu time spent up to now is 124.5 secs Computing kpt #: 121 total cpu time spent up to now is 125.6 secs Computing kpt #: 122 total cpu time spent up to now is 126.7 secs Computing kpt #: 123 total cpu time spent up to now is 127.8 secs Computing kpt #: 124 total cpu time spent up to now is 128.8 secs Computing kpt #: 125 total cpu time spent up to now is 129.8 secs Computing kpt #: 126 total cpu time spent up to now is 130.8 secs Computing kpt #: 127 total cpu time spent up to now is 131.8 secs Computing kpt #: 128 total cpu time spent up to now is 132.7 secs Computing kpt #: 129 total cpu time spent up to now is 133.7 secs Computing kpt #: 130 total cpu time spent up to now is 134.7 secs Computing kpt #: 131 total cpu time spent up to now is 135.6 secs Computing kpt #: 132 total cpu time spent up to now is 136.6 secs Computing kpt #: 133 total cpu time spent up to now is 137.6 secs Computing kpt #: 134 total cpu time spent up to now is 138.6 secs Computing kpt #: 135 total cpu time spent up to now is 139.6 secs Computing kpt #: 136 total cpu time spent up to now is 140.5 secs Computing kpt #: 137 total cpu time spent up to now is 141.5 secs Computing kpt #: 138 total cpu time spent up to now is 142.6 secs Computing kpt #: 139 total cpu time spent up to now is 143.7 secs Computing kpt #: 140 total cpu time spent up to now is 144.8 secs Computing kpt #: 141 total cpu time spent up to now is 145.9 secs Computing kpt #: 142 total cpu time spent up to now is 147.0 secs Computing kpt #: 143 total cpu time spent up to now is 148.1 secs Computing kpt #: 144 total cpu time spent up to now is 149.2 secs Computing kpt #: 145 total cpu time spent up to now is 150.1 secs Computing kpt #: 146 total cpu time spent up to now is 151.1 secs Computing kpt #: 147 total cpu time spent up to now is 152.0 secs Computing kpt #: 148 total cpu time spent up to now is 153.0 secs Computing kpt #: 149 total cpu time spent up to now is 153.9 secs Computing kpt #: 150 total cpu time spent up to now is 154.8 secs Computing kpt #: 151 total cpu time spent up to now is 155.7 secs Computing kpt #: 152 total cpu time spent up to now is 156.6 secs Computing kpt #: 153 total cpu time spent up to now is 157.5 secs Computing kpt #: 154 total cpu time spent up to now is 158.4 secs Computing kpt #: 155 total cpu time spent up to now is 159.2 secs Computing kpt #: 156 total cpu time spent up to now is 160.1 secs Computing kpt #: 157 total cpu time spent up to now is 161.0 secs Computing kpt #: 158 total cpu time spent up to now is 161.9 secs Computing kpt #: 159 total cpu time spent up to now is 162.8 secs Computing kpt #: 160 total cpu time spent up to now is 163.6 secs Computing kpt #: 161 total cpu time spent up to now is 164.5 secs Computing kpt #: 162 total cpu time spent up to now is 165.4 secs Computing kpt #: 163 total cpu time spent up to now is 166.3 secs Computing kpt #: 164 total cpu time spent up to now is 167.2 secs Computing kpt #: 165 total cpu time spent up to now is 168.0 secs Computing kpt #: 166 total cpu time spent up to now is 168.9 secs Computing kpt #: 167 total cpu time spent up to now is 169.8 secs Computing kpt #: 168 total cpu time spent up to now is 170.7 secs Computing kpt #: 169 total cpu time spent up to now is 171.7 secs Computing kpt #: 170 total cpu time spent up to now is 172.6 secs Computing kpt #: 171 total cpu time spent up to now is 173.5 secs Computing kpt #: 172 total cpu time spent up to now is 174.5 secs Computing kpt #: 173 total cpu time spent up to now is 175.6 secs Computing kpt #: 174 total cpu time spent up to now is 176.6 secs Computing kpt #: 175 total cpu time spent up to now is 177.6 secs Computing kpt #: 176 total cpu time spent up to now is 178.6 secs Computing kpt #: 177 total cpu time spent up to now is 179.6 secs Computing kpt #: 178 total cpu time spent up to now is 180.6 secs Computing kpt #: 179 total cpu time spent up to now is 181.5 secs Computing kpt #: 180 total cpu time spent up to now is 182.5 secs Computing kpt #: 181 total cpu time spent up to now is 183.4 secs Computing kpt #: 182 total cpu time spent up to now is 184.4 secs Computing kpt #: 183 total cpu time spent up to now is 185.4 secs Computing kpt #: 184 total cpu time spent up to now is 186.3 secs Computing kpt #: 185 total cpu time spent up to now is 187.3 secs Computing kpt #: 186 total cpu time spent up to now is 188.3 secs Computing kpt #: 187 total cpu time spent up to now is 189.2 secs Computing kpt #: 188 total cpu time spent up to now is 190.3 secs Computing kpt #: 189 total cpu time spent up to now is 191.2 secs Computing kpt #: 190 total cpu time spent up to now is 192.2 secs Computing kpt #: 191 total cpu time spent up to now is 193.2 secs Computing kpt #: 192 total cpu time spent up to now is 194.2 secs Computing kpt #: 193 total cpu time spent up to now is 195.2 secs Computing kpt #: 194 total cpu time spent up to now is 196.2 secs Computing kpt #: 195 total cpu time spent up to now is 197.2 secs Computing kpt #: 196 total cpu time spent up to now is 198.2 secs Computing kpt #: 197 total cpu time spent up to now is 199.2 secs Computing kpt #: 198 total cpu time spent up to now is 200.2 secs Computing kpt #: 199 total cpu time spent up to now is 201.1 secs Computing kpt #: 200 total cpu time spent up to now is 202.2 secs Computing kpt #: 201 total cpu time spent up to now is 203.3 secs Computing kpt #: 202 total cpu time spent up to now is 204.4 secs Computing kpt #: 203 total cpu time spent up to now is 205.6 secs Computing kpt #: 204 total cpu time spent up to now is 206.7 secs Computing kpt #: 205 total cpu time spent up to now is 207.8 secs Computing kpt #: 206 total cpu time spent up to now is 208.9 secs Computing kpt #: 207 total cpu time spent up to now is 210.0 secs Computing kpt #: 208 total cpu time spent up to now is 211.1 secs Computing kpt #: 209 total cpu time spent up to now is 212.2 secs Computing kpt #: 210 total cpu time spent up to now is 213.3 secs Computing kpt #: 211 total cpu time spent up to now is 214.4 secs Computing kpt #: 212 total cpu time spent up to now is 215.5 secs Computing kpt #: 213 total cpu time spent up to now is 216.6 secs Computing kpt #: 214 total cpu time spent up to now is 217.6 secs Computing kpt #: 215 total cpu time spent up to now is 218.6 secs Computing kpt #: 216 total cpu time spent up to now is 219.5 secs Computing kpt #: 217 total cpu time spent up to now is 220.5 secs Computing kpt #: 218 total cpu time spent up to now is 221.4 secs Computing kpt #: 219 total cpu time spent up to now is 222.3 secs Computing kpt #: 220 total cpu time spent up to now is 223.3 secs Computing kpt #: 221 total cpu time spent up to now is 224.2 secs Computing kpt #: 222 total cpu time spent up to now is 225.2 secs Computing kpt #: 223 total cpu time spent up to now is 226.1 secs Computing kpt #: 224 total cpu time spent up to now is 227.0 secs Computing kpt #: 225 total cpu time spent up to now is 228.0 secs Computing kpt #: 226 total cpu time spent up to now is 228.9 secs Computing kpt #: 227 total cpu time spent up to now is 229.9 secs Computing kpt #: 228 total cpu time spent up to now is 230.8 secs Computing kpt #: 229 total cpu time spent up to now is 231.8 secs Computing kpt #: 230 total cpu time spent up to now is 232.8 secs Computing kpt #: 231 total cpu time spent up to now is 233.7 secs Computing kpt #: 232 total cpu time spent up to now is 234.6 secs Computing kpt #: 233 total cpu time spent up to now is 235.5 secs Computing kpt #: 234 total cpu time spent up to now is 236.6 secs Computing kpt #: 235 total cpu time spent up to now is 237.6 secs Computing kpt #: 236 total cpu time spent up to now is 238.6 secs Computing kpt #: 237 total cpu time spent up to now is 239.6 secs Computing kpt #: 238 total cpu time spent up to now is 240.5 secs Computing kpt #: 239 total cpu time spent up to now is 241.5 secs Computing kpt #: 240 total cpu time spent up to now is 242.5 secs Computing kpt #: 241 total cpu time spent up to now is 243.4 secs Computing kpt #: 242 total cpu time spent up to now is 244.4 secs Computing kpt #: 243 total cpu time spent up to now is 245.5 secs Computing kpt #: 244 total cpu time spent up to now is 246.5 secs Computing kpt #: 245 total cpu time spent up to now is 247.5 secs Computing kpt #: 246 total cpu time spent up to now is 248.6 secs Computing kpt #: 247 total cpu time spent up to now is 249.6 secs Computing kpt #: 248 total cpu time spent up to now is 250.7 secs Computing kpt #: 249 total cpu time spent up to now is 251.8 secs Computing kpt #: 250 total cpu time spent up to now is 252.9 secs Computing kpt #: 251 total cpu time spent up to now is 254.0 secs Computing kpt #: 252 total cpu time spent up to now is 255.1 secs Computing kpt #: 253 total cpu time spent up to now is 256.2 secs Computing kpt #: 254 total cpu time spent up to now is 257.2 secs Computing kpt #: 255 total cpu time spent up to now is 258.4 secs Computing kpt #: 256 total cpu time spent up to now is 259.5 secs Computing kpt #: 257 total cpu time spent up to now is 260.6 secs Computing kpt #: 258 total cpu time spent up to now is 261.7 secs Computing kpt #: 259 total cpu time spent up to now is 262.8 secs Computing kpt #: 260 total cpu time spent up to now is 263.8 secs ethr = 1.52E-08, avg # of iterations = 19.6 total cpu time spent up to now is 263.8 secs End of band structure calculation k = 0.0000-0.2824-0.0961 ( 7844 PWs) bands (ev): -17.4453 -17.4453 -15.5905 -15.5905 -12.2924 -12.2924 -11.4675 -11.4675 -11.3274 -11.3274 -9.4421 -9.4421 -9.2817 -9.2817 -6.3379 -6.3379 -5.5930 -5.5930 -5.2455 -5.2455 -3.7025 -3.7025 -2.9562 -2.9562 -2.4585 -2.4585 -2.1679 -2.1679 -0.9908 -0.9908 -0.8177 -0.8177 -0.2687 -0.2687 -0.0923 -0.0923 0.1041 0.1041 0.2665 0.2665 0.3684 0.3684 0.5258 0.5258 0.6837 0.6837 2.0313 2.0313 2.5280 2.5280 2.6416 2.6416 2.7365 2.7365 2.9225 2.9225 3.2003 3.2003 3.2081 3.2081 3.5896 3.5896 3.6401 3.6401 3.8088 3.8088 4.9482 4.9482 5.8319 5.8319 6.6993 6.6993 7.8078 7.8078 8.6749 8.6749 9.4521 9.4521 9.5145 9.5145 k = 0.0000-0.2711-0.0923 ( 7847 PWs) bands (ev): -17.4453 -17.4453 -15.5905 -15.5905 -12.2923 -12.2923 -11.4676 -11.4676 -11.3272 -11.3272 -9.4422 -9.4422 -9.2818 -9.2818 -6.3379 -6.3379 -5.5930 -5.5930 -5.2452 -5.2452 -3.7022 -3.7022 -2.9562 -2.9562 -2.4588 -2.4588 -2.1674 -2.1674 -0.9908 -0.9908 -0.8205 -0.8205 -0.2678 -0.2678 -0.0911 -0.0911 0.1044 0.1044 0.2666 0.2666 0.3683 0.3683 0.5256 0.5256 0.6835 0.6835 2.0314 2.0314 2.5281 2.5281 2.6415 2.6415 2.7365 2.7365 2.9219 2.9219 3.2000 3.2000 3.2092 3.2092 3.5895 3.5895 3.6408 3.6408 3.8089 3.8089 4.9479 4.9479 5.8321 5.8321 6.6963 6.6963 7.8098 7.8098 8.6760 8.6760 9.4487 9.4487 9.5161 9.5161 k = 0.0000-0.2598-0.0884 ( 7841 PWs) bands (ev): -17.4453 -17.4453 -15.5904 -15.5904 -12.2921 -12.2921 -11.4681 -11.4681 -11.3268 -11.3268 -9.4425 -9.4425 -9.2821 -9.2821 -6.3378 -6.3378 -5.5930 -5.5930 -5.2445 -5.2445 -3.7013 -3.7013 -2.9563 -2.9563 -2.4597 -2.4597 -2.1662 -2.1662 -0.9910 -0.9910 -0.8285 -0.8285 -0.2653 -0.2653 -0.0874 -0.0874 0.1054 0.1054 0.2670 0.2670 0.3679 0.3679 0.5250 0.5250 0.6828 0.6828 2.0318 2.0318 2.5282 2.5282 2.6413 2.6413 2.7365 2.7365 2.9202 2.9202 3.1996 3.1996 3.2121 3.2121 3.5891 3.5891 3.6428 3.6428 3.8090 3.8090 4.9472 4.9472 5.8326 5.8326 6.6876 6.6876 7.8160 7.8160 8.6793 8.6793 9.4397 9.4397 9.5202 9.5202 k = 0.0000-0.2485-0.0846 ( 7843 PWs) bands (ev): -17.4454 -17.4454 -15.5903 -15.5903 -12.2917 -12.2917 -11.4689 -11.4689 -11.3261 -11.3261 -9.4429 -9.4429 -9.2827 -9.2827 -6.3376 -6.3376 -5.5929 -5.5929 -5.2433 -5.2433 -3.6997 -3.6997 -2.9563 -2.9563 -2.4611 -2.4611 -2.1640 -2.1640 -0.9912 -0.9912 -0.8416 -0.8416 -0.2613 -0.2613 -0.0814 -0.0814 0.1070 0.1070 0.2675 0.2675 0.3673 0.3673 0.5241 0.5241 0.6818 0.6818 2.0325 2.0325 2.5283 2.5283 2.6410 2.6410 2.7365 2.7365 2.9174 2.9174 3.1992 3.1992 3.2163 3.2163 3.5886 3.5886 3.6460 3.6460 3.8091 3.8091 4.9460 4.9460 5.8336 5.8336 6.6734 6.6734 7.8259 7.8259 8.6848 8.6848 9.4268 9.4268 9.5249 9.5249 k = 0.0000-0.2372-0.0807 ( 7848 PWs) bands (ev): -17.4454 -17.4454 -15.5903 -15.5903 -12.2913 -12.2913 -11.4700 -11.4700 -11.3251 -11.3251 -9.4435 -9.4435 -9.2835 -9.2835 -6.3373 -6.3373 -5.5928 -5.5928 -5.2417 -5.2417 -3.6976 -3.6976 -2.9563 -2.9563 -2.4631 -2.4631 -2.1610 -2.1610 -0.9915 -0.9915 -0.8591 -0.8591 -0.2562 -0.2562 -0.0733 -0.0733 0.1092 0.1092 0.2682 0.2682 0.3663 0.3663 0.5227 0.5227 0.6803 0.6803 2.0334 2.0334 2.5285 2.5285 2.6405 2.6405 2.7365 2.7365 2.9136 2.9136 3.1992 3.1992 3.2217 3.2217 3.5881 3.5881 3.6501 3.6501 3.8093 3.8093 4.9444 4.9444 5.8349 5.8349 6.6541 6.6541 7.8394 7.8394 8.6922 8.6922 9.4112 9.4112 9.5291 9.5291 k = 0.0000-0.2259-0.0769 ( 7852 PWs) bands (ev): -17.4455 -17.4455 -15.5901 -15.5901 -12.2907 -12.2907 -11.4714 -11.4714 -11.3239 -11.3239 -9.4442 -9.4442 -9.2845 -9.2845 -6.3370 -6.3370 -5.5927 -5.5927 -5.2396 -5.2396 -3.6949 -3.6949 -2.9564 -2.9564 -2.4655 -2.4655 -2.1572 -2.1572 -0.9920 -0.9920 -0.8806 -0.8806 -0.2502 -0.2502 -0.0633 -0.0633 0.1120 0.1120 0.2691 0.2691 0.3652 0.3652 0.5211 0.5211 0.6784 0.6784 2.0346 2.0346 2.5287 2.5287 2.6399 2.6399 2.7366 2.7366 2.9089 2.9089 3.1994 3.1994 3.2280 3.2280 3.5877 3.5877 3.6549 3.6549 3.8095 3.8095 4.9424 4.9424 5.8366 5.8366 6.6303 6.6303 7.8560 7.8560 8.7016 8.7016 9.3939 9.3939 9.5322 9.5322 k = 0.0000-0.2146-0.0730 ( 7853 PWs) bands (ev): -17.4456 -17.4456 -15.5900 -15.5900 -12.2900 -12.2900 -11.4730 -11.4730 -11.3225 -11.3225 -9.4450 -9.4450 -9.2857 -9.2857 -6.3366 -6.3366 -5.5926 -5.5926 -5.2372 -5.2372 -3.6917 -3.6917 -2.9565 -2.9565 -2.4684 -2.4684 -2.1526 -2.1526 -0.9926 -0.9926 -0.9053 -0.9053 -0.2436 -0.2436 -0.0517 -0.0517 0.1154 0.1154 0.2703 0.2703 0.3637 0.3637 0.5191 0.5191 0.6762 0.6762 2.0359 2.0359 2.5290 2.5290 2.6391 2.6391 2.7366 2.7366 2.9036 2.9036 3.1999 3.1999 3.2353 3.2353 3.5876 3.5876 3.6603 3.6603 3.8098 3.8098 4.9400 4.9400 5.8386 5.8386 6.6026 6.6026 7.8753 7.8753 8.7126 8.7126 9.3753 9.3753 9.5340 9.5340 k = 0.0000-0.2033-0.0692 ( 7856 PWs) bands (ev): -17.4457 -17.4457 -15.5898 -15.5898 -12.2891 -12.2891 -11.4749 -11.4749 -11.3209 -11.3209 -9.4460 -9.4460 -9.2870 -9.2870 -6.3362 -6.3362 -5.5925 -5.5925 -5.2344 -5.2344 -3.6880 -3.6880 -2.9565 -2.9565 -2.4717 -2.4717 -2.1472 -2.1472 -0.9934 -0.9934 -0.9326 -0.9326 -0.2365 -0.2365 -0.0389 -0.0389 0.1193 0.1193 0.2716 0.2716 0.3620 0.3620 0.5170 0.5170 0.6736 0.6736 2.0375 2.0375 2.5293 2.5293 2.6381 2.6381 2.7367 2.7367 2.8978 2.8978 3.2008 3.2008 3.2432 3.2432 3.5877 3.5877 3.6660 3.6660 3.8101 3.8101 4.9372 4.9372 5.8409 5.8409 6.5716 6.5716 7.8968 7.8968 8.7252 8.7252 9.3560 9.3560 9.5342 9.5342 k = 0.0000-0.1920-0.0654 ( 7855 PWs) bands (ev): -17.4458 -17.4458 -15.5897 -15.5897 -12.2882 -12.2882 -11.4769 -11.4769 -11.3192 -11.3192 -9.4471 -9.4471 -9.2886 -9.2886 -6.3357 -6.3357 -5.5924 -5.5924 -5.2313 -5.2313 -3.6839 -3.6839 -2.9566 -2.9566 -2.4753 -2.4753 -2.1410 -2.1410 -0.9951 -0.9951 -0.9614 -0.9614 -0.2293 -0.2293 -0.0252 -0.0252 0.1237 0.1237 0.2730 0.2730 0.3600 0.3600 0.5146 0.5146 0.6707 0.6707 2.0393 2.0393 2.5297 2.5297 2.6371 2.6371 2.7368 2.7368 2.8916 2.8916 3.2021 3.2021 3.2517 3.2517 3.5883 3.5883 3.6719 3.6719 3.8105 3.8105 4.9342 4.9342 5.8435 5.8435 6.5380 6.5380 7.9200 7.9200 8.7389 8.7389 9.3364 9.3364 9.5328 9.5328 k = 0.0000-0.1807-0.0615 ( 7850 PWs) bands (ev): -17.4459 -17.4459 -15.5895 -15.5895 -12.2872 -12.2872 -11.4790 -11.4790 -11.3173 -11.3173 -9.4483 -9.4483 -9.2902 -9.2902 -6.3351 -6.3351 -5.5922 -5.5922 -5.2280 -5.2280 -3.6793 -3.6793 -2.9567 -2.9567 -2.4791 -2.4791 -2.1341 -2.1341 -1.0032 -1.0032 -0.9854 -0.9854 -0.2219 -0.2219 -0.0110 -0.0110 0.1285 0.1285 0.2746 0.2746 0.3578 0.3578 0.5120 0.5120 0.6675 0.6675 2.0412 2.0412 2.5301 2.5301 2.6358 2.6358 2.7370 2.7370 2.8852 2.8852 3.2037 3.2037 3.2605 3.2605 3.5892 3.5892 3.6778 3.6778 3.8109 3.8109 4.9309 4.9309 5.8463 5.8463 6.5025 6.5025 7.9446 7.9446 8.7535 8.7535 9.3170 9.3170 9.5299 9.5299 k = 0.0000-0.1694-0.0577 ( 7854 PWs) bands (ev): -17.4460 -17.4460 -15.5893 -15.5893 -12.2862 -12.2862 -11.4813 -11.4813 -11.3154 -11.3154 -9.4495 -9.4495 -9.2919 -9.2919 -6.3345 -6.3345 -5.5921 -5.5921 -5.2245 -5.2245 -3.6745 -3.6745 -2.9568 -2.9568 -2.4832 -2.4832 -2.1265 -2.1265 -1.0305 -1.0305 -0.9916 -0.9916 -0.2146 -0.2146 0.0035 0.0035 0.1337 0.1337 0.2763 0.2763 0.3553 0.3553 0.5094 0.5094 0.6642 0.6642 2.0433 2.0433 2.5305 2.5305 2.6344 2.6344 2.7373 2.7373 2.8787 2.8787 3.2057 3.2057 3.2695 3.2695 3.5906 3.5906 3.6837 3.6837 3.8113 3.8113 4.9275 4.9275 5.8493 5.8493 6.4656 6.4656 7.9700 7.9700 8.7688 8.7688 9.2982 9.2982 9.5256 9.5256 k = 0.0000-0.1581-0.0538 ( 7853 PWs) bands (ev): -17.4461 -17.4461 -15.5891 -15.5891 -12.2851 -12.2851 -11.4836 -11.4836 -11.3134 -11.3134 -9.4508 -9.4508 -9.2937 -9.2937 -6.3339 -6.3339 -5.5920 -5.5920 -5.2209 -5.2209 -3.6694 -3.6694 -2.9568 -2.9568 -2.4874 -2.4874 -2.1181 -2.1181 -1.0633 -1.0633 -0.9932 -0.9932 -0.2073 -0.2073 0.0180 0.0180 0.1391 0.1391 0.2781 0.2781 0.3526 0.3526 0.5066 0.5066 0.6606 0.6606 2.0455 2.0455 2.5310 2.5310 2.6328 2.6328 2.7376 2.7376 2.8722 2.8722 3.2080 3.2080 3.2786 3.2786 3.5923 3.5923 3.6893 3.6893 3.8117 3.8117 4.9240 4.9240 5.8525 5.8525 6.4280 6.4280 7.9960 7.9960 8.7844 8.7844 9.2805 9.2805 9.5200 9.5200 k = 0.0000-0.1468-0.0500 ( 7851 PWs) bands (ev): -17.4463 -17.4463 -15.5889 -15.5889 -12.2840 -12.2840 -11.4859 -11.4859 -11.3114 -11.3114 -9.4521 -9.4521 -9.2955 -9.2955 -6.3332 -6.3332 -5.5918 -5.5918 -5.2171 -5.2171 -3.6641 -3.6641 -2.9569 -2.9569 -2.4918 -2.4918 -2.1092 -2.1092 -1.0970 -1.0970 -0.9942 -0.9942 -0.2001 -0.2001 0.0322 0.0322 0.1447 0.1447 0.2800 0.2800 0.3497 0.3497 0.5039 0.5039 0.6570 0.6570 2.0477 2.0477 2.5315 2.5315 2.6311 2.6311 2.7381 2.7381 2.8657 2.8657 3.2107 3.2107 3.2877 3.2877 3.5944 3.5944 3.6947 3.6947 3.8121 3.8121 4.9204 4.9204 5.8558 5.8558 6.3902 6.3902 8.0222 8.0222 8.7998 8.7998 9.2645 9.2645 9.5133 9.5133 k = 0.0000-0.1355-0.0461 ( 7854 PWs) bands (ev): -17.4464 -17.4464 -15.5886 -15.5886 -12.2828 -12.2828 -11.4882 -11.4882 -11.3094 -11.3094 -9.4535 -9.4535 -9.2974 -9.2974 -6.3326 -6.3326 -5.5916 -5.5916 -5.2134 -5.2134 -3.6587 -3.6587 -2.9569 -2.9569 -2.4962 -2.4962 -2.0996 -2.0996 -1.1310 -1.1310 -0.9951 -0.9951 -0.1931 -0.1931 0.0461 0.0461 0.1505 0.1505 0.2819 0.2819 0.3466 0.3466 0.5011 0.5011 0.6533 0.6533 2.0500 2.0500 2.5321 2.5321 2.6293 2.6293 2.7386 2.7386 2.8594 2.8594 3.2138 3.2138 3.2965 3.2965 3.5968 3.5968 3.6997 3.6997 3.8124 3.8124 4.9167 4.9167 5.8591 5.8591 6.3528 6.3528 8.0483 8.0483 8.8148 8.8148 9.2507 9.2507 9.5057 9.5057 k = 0.0000-0.1243-0.0423 ( 7851 PWs) bands (ev): -17.4465 -17.4465 -15.5884 -15.5884 -12.2817 -12.2817 -11.4905 -11.4905 -11.3075 -11.3075 -9.4548 -9.4548 -9.2992 -9.2992 -6.3319 -6.3319 -5.5915 -5.5915 -5.2097 -5.2097 -3.6532 -3.6532 -2.9569 -2.9569 -2.5005 -2.5005 -2.0895 -2.0895 -1.1647 -1.1647 -0.9958 -0.9958 -0.1864 -0.1864 0.0594 0.0594 0.1561 0.1561 0.2839 0.2839 0.3435 0.3435 0.4984 0.4984 0.6496 0.6496 2.0523 2.0523 2.5326 2.5326 2.6273 2.6273 2.7393 2.7393 2.8533 2.8533 3.2170 3.2170 3.3050 3.3050 3.5996 3.5996 3.7042 3.7042 3.8128 3.8128 4.9132 4.9132 5.8624 5.8624 6.3162 6.3162 8.0738 8.0738 8.8288 8.8288 9.2397 9.2397 9.4975 9.4975 k = 0.0000-0.1130-0.0384 ( 7849 PWs) bands (ev): -17.4466 -17.4466 -15.5882 -15.5882 -12.2806 -12.2806 -11.4927 -11.4927 -11.3056 -11.3056 -9.4561 -9.4561 -9.3010 -9.3010 -6.3313 -6.3313 -5.5914 -5.5914 -5.2061 -5.2061 -3.6479 -3.6479 -2.9569 -2.9569 -2.5048 -2.5048 -2.0790 -2.0790 -1.1977 -1.1977 -0.9966 -0.9966 -0.1799 -0.1799 0.0721 0.0721 0.1616 0.1616 0.2857 0.2857 0.3403 0.3403 0.4958 0.4958 0.6459 0.6459 2.0545 2.0545 2.5332 2.5332 2.6252 2.6252 2.7401 2.7401 2.8475 2.8475 3.2204 3.2204 3.3132 3.3132 3.6025 3.6025 3.7083 3.7083 3.8131 3.8131 4.9097 4.9097 5.8657 5.8657 6.2810 6.2810 8.0986 8.0986 8.8414 8.8414 9.2320 9.2320 9.4889 9.4889 k = 0.0000-0.1017-0.0346 ( 7859 PWs) bands (ev): -17.4468 -17.4468 -15.5880 -15.5880 -12.2795 -12.2795 -11.4948 -11.4948 -11.3038 -11.3038 -9.4574 -9.4574 -9.3028 -9.3028 -6.3306 -6.3306 -5.5912 -5.5912 -5.2027 -5.2027 -3.6427 -3.6427 -2.9569 -2.9569 -2.5089 -2.5089 -2.0681 -2.0681 -1.2297 -1.2297 -0.9972 -0.9972 -0.1739 -0.1739 0.0840 0.0840 0.1668 0.1668 0.2875 0.2875 0.3372 0.3372 0.4932 0.4932 0.6424 0.6424 2.0567 2.0567 2.5338 2.5338 2.6231 2.6231 2.7409 2.7409 2.8419 2.8419 3.2240 3.2240 3.3208 3.3208 3.6057 3.6057 3.7118 3.7118 3.8134 3.8134 4.9064 4.9064 5.8689 5.8689 6.2476 6.2476 8.1221 8.1221 8.8522 8.8522 9.2282 9.2282 9.4801 9.4801 k = 0.0000-0.0904-0.0308 ( 7860 PWs) bands (ev): -17.4469 -17.4469 -15.5878 -15.5878 -12.2785 -12.2785 -11.4967 -11.4967 -11.3022 -11.3022 -9.4585 -9.4585 -9.3044 -9.3044 -6.3301 -6.3301 -5.5911 -5.5911 -5.1995 -5.1995 -3.6377 -3.6377 -2.9568 -2.9568 -2.5129 -2.5129 -2.0572 -2.0572 -1.2602 -1.2602 -0.9978 -0.9978 -0.1683 -0.1683 0.0952 0.0952 0.1715 0.1715 0.2892 0.2892 0.3343 0.3343 0.4908 0.4908 0.6391 0.6391 2.0587 2.0587 2.5344 2.5344 2.6210 2.6210 2.7419 2.7419 2.8368 2.8368 3.2275 3.2275 3.3278 3.3278 3.6090 3.6090 3.7148 3.7148 3.8137 3.8137 4.9034 4.9034 5.8719 5.8719 6.2165 6.2165 8.1443 8.1443 8.8610 8.8610 9.2286 9.2286 9.4713 9.4713 k = 0.0000-0.0791-0.0269 ( 7855 PWs) bands (ev): -17.4470 -17.4470 -15.5876 -15.5876 -12.2776 -12.2776 -11.4985 -11.4985 -11.3007 -11.3007 -9.4596 -9.4596 -9.3059 -9.3059 -6.3295 -6.3295 -5.5910 -5.5910 -5.1965 -5.1965 -3.6330 -3.6330 -2.9568 -2.9568 -2.5165 -2.5165 -2.0464 -2.0464 -1.2887 -1.2887 -0.9984 -0.9984 -0.1632 -0.1632 0.1056 0.1056 0.1757 0.1757 0.2907 0.2907 0.3315 0.3315 0.4885 0.4885 0.6361 0.6361 2.0606 2.0606 2.5350 2.5350 2.6190 2.6190 2.7429 2.7429 2.8321 2.8321 3.2309 3.2309 3.3342 3.3342 3.6123 3.6123 3.7173 3.7173 3.8139 3.8139 4.9005 4.9005 5.8747 5.8747 6.1880 6.1880 8.1647 8.1647 8.8677 8.8677 9.2334 9.2334 9.4629 9.4629 k = 0.0000-0.0678-0.0231 ( 7852 PWs) bands (ev): -17.4471 -17.4471 -15.5875 -15.5875 -12.2767 -12.2767 -11.5001 -11.5001 -11.2993 -11.2993 -9.4606 -9.4606 -9.3073 -9.3073 -6.3290 -6.3290 -5.5909 -5.5909 -5.1938 -5.1938 -3.6288 -3.6288 -2.9568 -2.9568 -2.5199 -2.5199 -2.0359 -2.0359 -1.3149 -1.3149 -0.9989 -0.9989 -0.1587 -0.1587 0.1151 0.1151 0.1790 0.1790 0.2921 0.2921 0.3291 0.3291 0.4864 0.4864 0.6333 0.6333 2.0623 2.0623 2.5356 2.5356 2.6171 2.6171 2.7440 2.7440 2.8279 2.8279 3.2342 3.2342 3.3398 3.3398 3.6156 3.6156 3.7193 3.7193 3.8141 3.8141 4.8980 4.8980 5.8773 5.8773 6.1625 6.1625 8.1831 8.1831 8.8724 8.8724 9.2426 9.2426 9.4550 9.4550 k = 0.0000-0.0565-0.0192 ( 7850 PWs) bands (ev): -17.4471 -17.4471 -15.5874 -15.5874 -12.2760 -12.2760 -11.5015 -11.5015 -11.2981 -11.2981 -9.4615 -9.4615 -9.3084 -9.3084 -6.3286 -6.3286 -5.5908 -5.5908 -5.1915 -5.1915 -3.6251 -3.6251 -2.9567 -2.9567 -2.5228 -2.5228 -2.0261 -2.0261 -1.3383 -1.3383 -0.9994 -0.9994 -0.1548 -0.1548 0.1236 0.1236 0.1816 0.1816 0.2932 0.2932 0.3271 0.3271 0.4845 0.4845 0.6309 0.6309 2.0639 2.0639 2.5361 2.5361 2.6153 2.6153 2.7450 2.7450 2.8241 2.8241 3.2371 3.2371 3.3447 3.3447 3.6186 3.6186 3.7209 3.7209 3.8142 3.8142 4.8958 4.8958 5.8795 5.8795 6.1403 6.1403 8.1991 8.1991 8.8753 8.8753 9.2557 9.2557 9.4478 9.4478 k = 0.0000-0.0452-0.0154 ( 7843 PWs) bands (ev): -17.4472 -17.4472 -15.5872 -15.5872 -12.2753 -12.2753 -11.5027 -11.5027 -11.2972 -11.2972 -9.4622 -9.4622 -9.3094 -9.3094 -6.3282 -6.3282 -5.5907 -5.5907 -5.1895 -5.1895 -3.6219 -3.6219 -2.9566 -2.9566 -2.5253 -2.5253 -2.0173 -2.0173 -1.3583 -1.3583 -0.9998 -0.9998 -0.1515 -0.1515 0.1311 0.1311 0.1834 0.1834 0.2942 0.2942 0.3254 0.3254 0.4829 0.4829 0.6289 0.6289 2.0652 2.0652 2.5366 2.5366 2.6138 2.6138 2.7460 2.7460 2.8209 2.8209 3.2397 3.2397 3.3487 3.3487 3.6214 3.6214 3.7220 3.7220 3.8144 3.8144 4.8939 4.8939 5.8814 5.8814 6.1217 6.1217 8.2126 8.2126 8.8768 8.8768 9.2722 9.2722 9.4413 9.4413 k = 0.0000-0.0339-0.0115 ( 7843 PWs) bands (ev): -17.4473 -17.4473 -15.5871 -15.5871 -12.2748 -12.2748 -11.5036 -11.5036 -11.2964 -11.2964 -9.4628 -9.4628 -9.3102 -9.3102 -6.3279 -6.3279 -5.5907 -5.5907 -5.1880 -5.1880 -3.6194 -3.6194 -2.9566 -2.9566 -2.5273 -2.5273 -2.0100 -2.0100 -1.3746 -1.3746 -1.0000 -1.0000 -0.1489 -0.1489 0.1373 0.1373 0.1844 0.1844 0.2949 0.2949 0.3242 0.3242 0.4816 0.4816 0.6273 0.6273 2.0662 2.0662 2.5370 2.5370 2.6125 2.6125 2.7468 2.7468 2.8184 2.8184 3.2418 3.2418 3.3519 3.3519 3.6236 3.6236 3.7228 3.7228 3.8144 3.8144 4.8925 4.8925 5.8829 5.8829 6.1070 6.1070 8.2233 8.2233 8.8775 8.8775 9.2910 9.2910 9.4355 9.4355 k = 0.0000-0.0226-0.0077 ( 7841 PWs) bands (ev): -17.4473 -17.4473 -15.5871 -15.5871 -12.2745 -12.2745 -11.5043 -11.5043 -11.2958 -11.2958 -9.4632 -9.4632 -9.3108 -9.3108 -6.3277 -6.3277 -5.5906 -5.5906 -5.1869 -5.1869 -3.6176 -3.6176 -2.9566 -2.9566 -2.5287 -2.5287 -2.0044 -2.0044 -1.3865 -1.3865 -1.0003 -1.0003 -0.1471 -0.1471 0.1421 0.1421 0.1848 0.1848 0.2954 0.2954 0.3233 0.3233 0.4806 0.4806 0.6261 0.6261 2.0669 2.0669 2.5373 2.5373 2.6116 2.6116 2.7475 2.7475 2.8165 2.8165 3.2433 3.2433 3.3541 3.3541 3.6254 3.6254 3.7233 3.7233 3.8145 3.8145 4.8914 4.8914 5.8840 5.8840 6.0964 6.0964 8.2311 8.2311 8.8776 8.8776 9.3107 9.3107 9.4297 9.4297 k = 0.0000-0.0113-0.0038 ( 7838 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5047 -11.5047 -11.2955 -11.2955 -9.4634 -9.4634 -9.3111 -9.3111 -6.3275 -6.3275 -5.5906 -5.5906 -5.1862 -5.1862 -3.6165 -3.6165 -2.9565 -2.9565 -2.5296 -2.5296 -2.0009 -2.0009 -1.3939 -1.3939 -1.0004 -1.0004 -0.1459 -0.1459 0.1451 0.1451 0.1849 0.1849 0.2957 0.2957 0.3228 0.3228 0.4800 0.4800 0.6254 0.6254 2.0674 2.0674 2.5375 2.5375 2.6110 2.6110 2.7479 2.7479 2.8153 2.8153 3.2442 3.2442 3.3555 3.3555 3.6265 3.6265 3.7236 3.7236 3.8145 3.8145 4.8908 4.8908 5.8847 5.8847 6.0899 6.0899 8.2359 8.2359 8.8776 8.8776 9.3279 9.3279 9.4230 9.4230 k = 0.0000 0.0000 0.0000 ( 7841 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5048 -11.5048 -11.2954 -11.2954 -9.4635 -9.4635 -9.3113 -9.3113 -6.3275 -6.3275 -5.5906 -5.5906 -5.1860 -5.1860 -3.6161 -3.6161 -2.9565 -2.9565 -2.5299 -2.5299 -1.9997 -1.9997 -1.3964 -1.3964 -1.0004 -1.0004 -0.1455 -0.1455 0.1462 0.1462 0.1849 0.1849 0.2958 0.2958 0.3227 0.3227 0.4798 0.4798 0.6252 0.6252 2.0676 2.0676 2.5375 2.5375 2.6108 2.6108 2.7480 2.7480 2.8149 2.8149 3.2445 3.2445 3.3560 3.3560 3.6268 3.6268 3.7237 3.7237 3.8145 3.8145 4.8906 4.8906 5.8849 5.8849 6.0878 6.0878 8.2375 8.2375 8.8775 8.8775 9.3355 9.3355 9.4187 9.4187 k = 0.0000 0.0000 0.0000 ( 7841 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5048 -11.5048 -11.2954 -11.2954 -9.4635 -9.4635 -9.3113 -9.3113 -6.3275 -6.3275 -5.5906 -5.5906 -5.1860 -5.1860 -3.6161 -3.6161 -2.9565 -2.9565 -2.5299 -2.5299 -1.9997 -1.9997 -1.3964 -1.3964 -1.0004 -1.0004 -0.1455 -0.1455 0.1462 0.1462 0.1849 0.1849 0.2958 0.2958 0.3227 0.3227 0.4798 0.4798 0.6252 0.6252 2.0676 2.0676 2.5375 2.5375 2.6108 2.6108 2.7480 2.7480 2.8149 2.8149 3.2445 3.2445 3.3560 3.3560 3.6268 3.6268 3.7237 3.7237 3.8145 3.8145 4.8906 4.8906 5.8849 5.8849 6.0878 6.0878 8.2375 8.2375 8.8775 8.8775 9.3355 9.3355 9.4187 9.4187 k = 0.0119 0.0009 0.0024 ( 7841 PWs) bands (ev): -17.4472 -17.4472 -15.5870 -15.5870 -12.2742 -12.2742 -11.5045 -11.5045 -11.2952 -11.2952 -9.4635 -9.4635 -9.3112 -9.3112 -6.3275 -6.3275 -5.5906 -5.5906 -5.1860 -5.1860 -3.6161 -3.6161 -2.9579 -2.9579 -2.5298 -2.5298 -1.9998 -1.9998 -1.3956 -1.3956 -1.0012 -1.0012 -0.1458 -0.1458 0.1457 0.1457 0.1845 0.1845 0.2935 0.2935 0.3236 0.3236 0.4804 0.4804 0.6251 0.6251 2.0676 2.0676 2.5369 2.5369 2.6110 2.6110 2.7479 2.7479 2.8147 2.8147 3.2410 3.2410 3.3574 3.3574 3.6267 3.6267 3.7231 3.7231 3.8128 3.8128 4.8904 4.8904 5.8852 5.8852 6.0914 6.0914 8.2429 8.2429 8.8791 8.8791 9.3316 9.3316 9.4231 9.4231 k = 0.0238 0.0019 0.0048 ( 7842 PWs) bands (ev): -17.4469 -17.4469 -15.5868 -15.5868 -12.2742 -12.2742 -11.5035 -11.5035 -11.2947 -11.2947 -9.4633 -9.4633 -9.3112 -9.3112 -6.3274 -6.3274 -5.5907 -5.5907 -5.1861 -5.1861 -3.6161 -3.6161 -2.9621 -2.9621 -2.5293 -2.5293 -2.0000 -2.0000 -1.3933 -1.3933 -1.0037 -1.0037 -0.1467 -0.1467 0.1443 0.1443 0.1834 0.1834 0.2875 0.2875 0.3255 0.3255 0.4820 0.4820 0.6249 0.6249 2.0676 2.0676 2.5350 2.5350 2.6117 2.6117 2.7476 2.7476 2.8141 2.8141 3.2309 3.2309 3.3613 3.3613 3.6262 3.6262 3.7215 3.7215 3.8077 3.8077 4.8900 4.8900 5.8862 5.8862 6.1022 6.1022 8.2592 8.2592 8.8837 8.8837 9.3217 9.3217 9.4348 9.4348 k = 0.0357 0.0028 0.0072 ( 7848 PWs) bands (ev): -17.4464 -17.4464 -15.5864 -15.5864 -12.2743 -12.2743 -11.5018 -11.5018 -11.2938 -11.2938 -9.4631 -9.4631 -9.3112 -9.3112 -6.3274 -6.3274 -5.5908 -5.5908 -5.1862 -5.1862 -3.6162 -3.6162 -2.9690 -2.9690 -2.5286 -2.5286 -2.0002 -2.0002 -1.3895 -1.3895 -1.0077 -1.0077 -0.1481 -0.1481 0.1417 0.1417 0.1811 0.1811 0.2792 0.2792 0.3273 0.3273 0.4847 0.4847 0.6245 0.6245 2.0677 2.0677 2.5320 2.5320 2.6127 2.6127 2.7472 2.7472 2.8130 2.8130 3.2157 3.2157 3.3664 3.3664 3.6253 3.6253 3.7188 3.7188 3.7994 3.7994 4.8894 4.8894 5.8879 5.8879 6.1199 6.1199 8.2862 8.2862 8.8911 8.8911 9.3084 9.3084 9.4499 9.4499 k = 0.0476 0.0038 0.0096 ( 7850 PWs) bands (ev): -17.4457 -17.4457 -15.5859 -15.5859 -12.2744 -12.2744 -11.4994 -11.4994 -11.2925 -11.2925 -9.4627 -9.4627 -9.3112 -9.3112 -6.3273 -6.3273 -5.5909 -5.5909 -5.1864 -5.1864 -3.6163 -3.6163 -2.9786 -2.9786 -2.5277 -2.5277 -2.0006 -2.0006 -1.3842 -1.3842 -1.0132 -1.0132 -0.1502 -0.1502 0.1380 0.1380 0.1775 0.1775 0.2696 0.2696 0.3286 0.3286 0.4884 0.4884 0.6242 0.6242 2.0678 2.0678 2.5278 2.5278 2.6141 2.6141 2.7465 2.7465 2.8115 2.8115 3.1969 3.1969 3.3716 3.3716 3.6239 3.6239 3.7151 3.7151 3.7883 3.7883 4.8884 4.8884 5.8902 5.8902 6.1442 6.1442 8.3233 8.3233 8.9011 8.9011 9.2934 9.2934 9.4627 9.4627 k = 0.0595 0.0047 0.0120 ( 7860 PWs) bands (ev): -17.4449 -17.4449 -15.5853 -15.5853 -12.2745 -12.2745 -11.4963 -11.4963 -11.2909 -11.2909 -9.4622 -9.4622 -9.3112 -9.3112 -6.3271 -6.3271 -5.5911 -5.5911 -5.1867 -5.1867 -3.6164 -3.6164 -2.9908 -2.9908 -2.5264 -2.5264 -2.0011 -2.0011 -1.3775 -1.3775 -1.0203 -1.0203 -0.1531 -0.1531 0.1327 0.1327 0.1721 0.1721 0.2597 0.2597 0.3294 0.3294 0.4930 0.4930 0.6240 0.6240 2.0680 2.0680 2.5226 2.5226 2.6156 2.6156 2.7457 2.7457 2.8094 2.8094 3.1753 3.1753 3.3765 3.3765 3.6218 3.6218 3.7102 3.7102 3.7747 3.7747 4.8872 4.8872 5.8931 5.8931 6.1746 6.1746 8.3701 8.3701 8.9131 8.9131 9.2776 9.2776 9.4724 9.4724 k = 0.0714 0.0057 0.0145 ( 7865 PWs) bands (ev): -17.4438 -17.4438 -15.5846 -15.5846 -12.2747 -12.2747 -11.4926 -11.4926 -11.2890 -11.2890 -9.4617 -9.4617 -9.3112 -9.3112 -6.3269 -6.3269 -5.5914 -5.5914 -5.1869 -5.1869 -3.6166 -3.6166 -3.0055 -3.0055 -2.5249 -2.5249 -2.0017 -2.0017 -1.3694 -1.3694 -1.0288 -1.0288 -0.1569 -0.1569 0.1254 0.1254 0.1644 0.1644 0.2500 0.2500 0.3300 0.3300 0.4986 0.4986 0.6239 0.6239 2.0682 2.0682 2.5164 2.5164 2.6171 2.6171 2.7447 2.7447 2.8067 2.8067 3.1520 3.1520 3.3805 3.3805 3.6189 3.6189 3.7043 3.7043 3.7594 3.7594 4.8856 4.8856 5.8964 5.8964 6.2106 6.2106 8.4257 8.4257 8.9268 8.9268 9.2616 9.2616 9.4814 9.4814 k = 0.0833 0.0066 0.0169 ( 7860 PWs) bands (ev): -17.4425 -17.4425 -15.5838 -15.5838 -12.2748 -12.2748 -11.4883 -11.4883 -11.2868 -11.2868 -9.4610 -9.4610 -9.3112 -9.3112 -6.3267 -6.3267 -5.5916 -5.5916 -5.1873 -5.1873 -3.6167 -3.6167 -3.0224 -3.0224 -2.5232 -2.5232 -2.0024 -2.0024 -1.3601 -1.3601 -1.0387 -1.0387 -0.1618 -0.1618 0.1156 0.1156 0.1544 0.1544 0.2412 0.2412 0.3308 0.3308 0.5050 0.5050 0.6242 0.6242 2.0686 2.0686 2.5095 2.5095 2.6185 2.6185 2.7435 2.7435 2.8034 2.8034 3.1276 3.1276 3.3838 3.3838 3.6150 3.6150 3.6972 3.6972 3.7430 3.7430 4.8837 4.8837 5.9003 5.9003 6.2518 6.2518 8.4893 8.4893 8.9415 8.9415 9.2462 9.2462 9.4902 9.4902 k = 0.0952 0.0075 0.0193 ( 7864 PWs) bands (ev): -17.4411 -17.4411 -15.5828 -15.5828 -12.2750 -12.2750 -11.4834 -11.4834 -11.2842 -11.2842 -9.4603 -9.4603 -9.3111 -9.3111 -6.3265 -6.3265 -5.5919 -5.5919 -5.1876 -5.1876 -3.6169 -3.6169 -3.0415 -3.0415 -2.5213 -2.5213 -2.0031 -2.0031 -1.3495 -1.3495 -1.0499 -1.0499 -0.1679 -0.1679 0.1026 0.1026 0.1425 0.1425 0.2334 0.2334 0.3322 0.3322 0.5121 0.5121 0.6249 0.6249 2.0691 2.0691 2.5017 2.5017 2.6198 2.6198 2.7421 2.7421 2.7994 2.7994 3.1029 3.1029 3.3860 3.3860 3.6100 3.6100 3.6887 3.6887 3.7261 3.7261 4.8814 4.8814 5.9045 5.9045 6.2974 6.2974 8.5594 8.5594 8.9566 8.9566 9.2318 9.2318 9.4987 9.4987 k = 0.1071 0.0085 0.0217 ( 7851 PWs) bands (ev): -17.4395 -17.4395 -15.5817 -15.5817 -12.2753 -12.2753 -11.4778 -11.4778 -11.2814 -11.2814 -9.4594 -9.4594 -9.3111 -9.3111 -6.3262 -6.3262 -5.5923 -5.5923 -5.1880 -5.1880 -3.6171 -3.6171 -3.0626 -3.0626 -2.5191 -2.5191 -2.0040 -2.0040 -1.3378 -1.3378 -1.0624 -1.0624 -0.1756 -0.1756 0.0860 0.0860 0.1290 0.1290 0.2268 0.2268 0.3346 0.3346 0.5197 0.5197 0.6261 0.6261 2.0698 2.0698 2.4932 2.4932 2.6207 2.6207 2.7405 2.7405 2.7948 2.7948 3.0784 3.0784 3.3873 3.3873 3.6035 3.6035 3.6787 3.6787 3.7098 3.7098 4.8788 4.8788 5.9089 5.9089 6.3469 6.3469 8.6345 8.6345 8.9715 8.9715 9.2194 9.2194 9.5066 9.5066 k = 0.1190 0.0094 0.0241 ( 7848 PWs) bands (ev): -17.4377 -17.4377 -15.5805 -15.5805 -12.2755 -12.2755 -11.4717 -11.4717 -11.2783 -11.2783 -9.4585 -9.4585 -9.3111 -9.3111 -6.3259 -6.3259 -5.5927 -5.5927 -5.1885 -5.1885 -3.6173 -3.6173 -3.0856 -3.0856 -2.5168 -2.5168 -2.0050 -2.0050 -1.3251 -1.3251 -1.0759 -1.0759 -0.1850 -0.1850 0.0660 0.0660 0.1146 0.1146 0.2212 0.2212 0.3382 0.3382 0.5278 0.5278 0.6277 0.6277 2.0708 2.0708 2.4840 2.4840 2.6212 2.6212 2.7385 2.7385 2.7895 2.7895 3.0545 3.0545 3.3877 3.3877 3.5955 3.5955 3.6669 3.6669 3.6948 3.6948 4.8759 4.8759 5.9134 5.9134 6.3998 6.3998 8.7120 8.7120 8.9856 8.9856 9.2104 9.2104 9.5138 9.5138 k = 0.1310 0.0104 0.0265 ( 7852 PWs) bands (ev): -17.4358 -17.4358 -15.5792 -15.5792 -12.2758 -12.2758 -11.4651 -11.4651 -11.2749 -11.2749 -9.4575 -9.4575 -9.3111 -9.3111 -6.3256 -6.3256 -5.5931 -5.5931 -5.1889 -5.1889 -3.6176 -3.6176 -3.1101 -3.1101 -2.5143 -2.5143 -2.0060 -2.0060 -1.3115 -1.3115 -1.0905 -1.0905 -0.1966 -0.1966 0.0429 0.0429 0.0994 0.0994 0.2165 0.2165 0.3431 0.3431 0.5362 0.5362 0.6299 0.6299 2.0718 2.0718 2.4741 2.4741 2.6212 2.6212 2.7359 2.7359 2.7837 2.7837 3.0320 3.0320 3.3872 3.3872 3.5858 3.5858 3.6535 3.6535 3.6815 3.6815 4.8727 4.8727 5.9180 5.9180 6.4556 6.4556 8.7883 8.7883 8.9983 8.9983 9.2067 9.2067 9.5202 9.5202 k = 0.1429 0.0113 0.0289 ( 7845 PWs) bands (ev): -17.4338 -17.4338 -15.5778 -15.5778 -12.2761 -12.2761 -11.4579 -11.4579 -11.2713 -11.2713 -9.4564 -9.4564 -9.3111 -9.3111 -6.3253 -6.3253 -5.5936 -5.5936 -5.1894 -5.1894 -3.6178 -3.6178 -3.1360 -3.1360 -2.5117 -2.5117 -2.0072 -2.0072 -1.2972 -1.2972 -1.1061 -1.1061 -0.2105 -0.2105 0.0174 0.0174 0.0836 0.0836 0.2124 0.2124 0.3492 0.3492 0.5448 0.5448 0.6326 0.6326 2.0732 2.0732 2.4637 2.4637 2.6205 2.6205 2.7326 2.7326 2.7778 2.7778 3.0111 3.0111 3.3858 3.3858 3.5744 3.5744 3.6391 3.6391 3.6695 3.6695 4.8693 4.8693 5.9225 5.9225 6.5138 6.5138 8.8576 8.8576 9.0102 9.0102 9.2109 9.2109 9.5257 9.5257 k = 0.1548 0.0123 0.0313 ( 7853 PWs) bands (ev): -17.4316 -17.4316 -15.5764 -15.5764 -12.2764 -12.2764 -11.4503 -11.4503 -11.2675 -11.2675 -9.4553 -9.4553 -9.3111 -9.3111 -6.3249 -6.3249 -5.5940 -5.5940 -5.1899 -5.1899 -3.6181 -3.6181 -3.1632 -3.1632 -2.5090 -2.5090 -2.0084 -2.0084 -1.2824 -1.2824 -1.1224 -1.1224 -0.2272 -0.2272 -0.0099 -0.0099 0.0678 0.0678 0.2089 0.2089 0.3566 0.3566 0.5535 0.5535 0.6358 0.6358 2.0749 2.0749 2.4527 2.4527 2.6190 2.6190 2.7279 2.7279 2.7722 2.7722 2.9922 2.9922 3.3834 3.3834 3.5615 3.5615 3.6244 3.6244 3.6584 3.6584 4.8658 4.8658 5.9267 5.9267 6.5739 6.5739 8.9104 8.9104 9.0248 9.0248 9.2251 9.2251 9.5304 9.5304 k = 0.1667 0.0132 0.0337 ( 7844 PWs) bands (ev): -17.4293 -17.4293 -15.5748 -15.5748 -12.2767 -12.2767 -11.4422 -11.4422 -11.2635 -11.2635 -9.4541 -9.4541 -9.3111 -9.3111 -6.3244 -6.3244 -5.5945 -5.5945 -5.1903 -5.1903 -3.6184 -3.6184 -3.1914 -3.1914 -2.5061 -2.5061 -2.0098 -2.0098 -1.2672 -1.2672 -1.1395 -1.1395 -0.2468 -0.2468 -0.0385 -0.0385 0.0522 0.0522 0.2058 0.2058 0.3651 0.3651 0.5622 0.5622 0.6395 0.6395 2.0769 2.0769 2.4413 2.4413 2.6164 2.6164 2.7218 2.7218 2.7677 2.7677 2.9754 2.9754 3.3801 3.3801 3.5475 3.5475 3.6097 3.6097 3.6478 3.6478 4.8621 4.8621 5.9307 5.9307 6.6356 6.6356 8.9371 8.9371 9.0471 9.0471 9.2482 9.2482 9.5348 9.5348 k = 0.1786 0.0141 0.0361 ( 7846 PWs) bands (ev): -17.4269 -17.4269 -15.5732 -15.5732 -12.2771 -12.2771 -11.4338 -11.4338 -11.2594 -11.2594 -9.4528 -9.4528 -9.3111 -9.3111 -6.3240 -6.3240 -5.5951 -5.5951 -5.1908 -5.1908 -3.6187 -3.6187 -3.2204 -3.2204 -2.5032 -2.5032 -2.0113 -2.0113 -1.2518 -1.2518 -1.1570 -1.1570 -0.2694 -0.2694 -0.0680 -0.0680 0.0374 0.0374 0.2030 0.2030 0.3745 0.3745 0.5708 0.5708 0.6437 0.6437 2.0792 2.0792 2.4294 2.4294 2.6127 2.6127 2.7142 2.7142 2.7644 2.7644 2.9607 2.9607 3.3758 3.3758 3.5328 3.5328 3.5951 3.5951 3.6374 3.6374 4.8584 4.8584 5.9343 5.9343 6.6984 6.6984 8.9407 8.9407 9.0736 9.0736 9.2720 9.2720 9.5398 9.5398 k = 0.1905 0.0151 0.0385 ( 7849 PWs) bands (ev): -17.4244 -17.4244 -15.5715 -15.5715 -12.2775 -12.2775 -11.4249 -11.4249 -11.2551 -11.2551 -9.4514 -9.4514 -9.3111 -9.3111 -6.3235 -6.3235 -5.5957 -5.5957 -5.1913 -5.1913 -3.6191 -3.6191 -3.2500 -3.2500 -2.5002 -2.5002 -2.0129 -2.0129 -1.2366 -1.2366 -1.1748 -1.1748 -0.2950 -0.2950 -0.0977 -0.0977 0.0235 0.0235 0.2004 0.2004 0.3849 0.3849 0.5792 0.5792 0.6483 0.6483 2.0818 2.0818 2.4173 2.4173 2.6075 2.6075 2.7055 2.7055 2.7624 2.7624 2.9481 2.9481 3.3705 3.3705 3.5178 3.5178 3.5805 3.5805 3.6272 3.6272 4.8547 4.8547 5.9374 5.9374 6.7621 6.7621 8.9317 8.9317 9.0982 9.0982 9.2835 9.2835 9.5463 9.5463 k = 0.2024 0.0160 0.0409 ( 7846 PWs) bands (ev): -17.4219 -17.4219 -15.5698 -15.5698 -12.2779 -12.2779 -11.4157 -11.4157 -11.2507 -11.2507 -9.4501 -9.4501 -9.3111 -9.3111 -6.3230 -6.3230 -5.5962 -5.5962 -5.1918 -5.1918 -3.6195 -3.6195 -3.2800 -3.2800 -2.4972 -2.4972 -2.0147 -2.0147 -1.2226 -1.2226 -1.1920 -1.1920 -0.3234 -0.3234 -0.1272 -0.1272 0.0108 0.0108 0.1977 0.1977 0.3959 0.3959 0.5874 0.5874 0.6533 0.6533 2.0849 2.0849 2.4049 2.4049 2.6009 2.6009 2.6965 2.6965 2.7616 2.7616 2.9374 2.9374 3.3641 3.3641 3.5027 3.5027 3.5659 3.5659 3.6171 3.6171 4.8511 4.8511 5.9400 5.9400 6.8263 6.8263 8.9157 8.9157 9.1192 9.1192 9.2738 9.2738 9.5528 9.5528 k = 0.2143 0.0170 0.0434 ( 7851 PWs) bands (ev): -17.4192 -17.4192 -15.5680 -15.5680 -12.2783 -12.2783 -11.4062 -11.4062 -11.2463 -11.2463 -9.4486 -9.4486 -9.3111 -9.3111 -6.3225 -6.3225 -5.5968 -5.5968 -5.1922 -5.1922 -3.6201 -3.6201 -3.3102 -3.3102 -2.4942 -2.4942 -2.0166 -2.0166 -1.2190 -1.2190 -1.1996 -1.1996 -0.3542 -0.3542 -0.1561 -0.1561 -0.0007 -0.0007 0.1950 0.1950 0.4075 0.4075 0.5953 0.5953 0.6587 0.6587 2.0883 2.0883 2.3925 2.3925 2.5927 2.5927 2.6875 2.6875 2.7617 2.7617 2.9283 2.9283 3.3566 3.3566 3.4876 3.4876 3.5514 3.5514 3.6072 3.6072 4.8475 4.8475 5.9420 5.9420 6.8907 6.8907 8.8954 8.8954 9.1367 9.1367 9.2442 9.2442 9.5560 9.5560 k = 0.2262 0.0179 0.0458 ( 7852 PWs) bands (ev): -17.4165 -17.4165 -15.5662 -15.5662 -12.2787 -12.2787 -11.3965 -11.3965 -11.2418 -11.2418 -9.4472 -9.4472 -9.3112 -9.3112 -6.3220 -6.3220 -5.5975 -5.5975 -5.1927 -5.1927 -3.6207 -3.6207 -3.3404 -3.3404 -2.4912 -2.4912 -2.0187 -2.0187 -1.2345 -1.2345 -1.1889 -1.1889 -0.3870 -0.3870 -0.1840 -0.1840 -0.0111 -0.0111 0.1922 0.1922 0.4196 0.4196 0.6030 0.6030 0.6644 0.6644 2.0921 2.0921 2.3799 2.3799 2.5832 2.5832 2.6791 2.6791 2.7626 2.7626 2.9208 2.9208 3.3480 3.3480 3.4726 3.4726 3.5370 3.5370 3.5974 3.5974 4.8440 4.8440 5.9433 5.9433 6.9551 6.9551 8.8717 8.8717 9.1467 9.1467 9.2060 9.2060 9.5542 9.5542 k = 0.2381 0.0189 0.0482 ( 7848 PWs) bands (ev): -17.4138 -17.4138 -15.5644 -15.5644 -12.2791 -12.2791 -11.3866 -11.3866 -11.2373 -11.2373 -9.4457 -9.4457 -9.3112 -9.3112 -6.3214 -6.3214 -5.5981 -5.5981 -5.1931 -5.1931 -3.6214 -3.6214 -3.3703 -3.3703 -2.4883 -2.4883 -2.0210 -2.0210 -1.2529 -1.2529 -1.1762 -1.1762 -0.4214 -0.4214 -0.2103 -0.2103 -0.0205 -0.0205 0.1891 0.1891 0.4321 0.4321 0.6104 0.6104 0.6704 0.6704 2.0962 2.0962 2.3675 2.3675 2.5725 2.5725 2.6713 2.6713 2.7642 2.7642 2.9145 2.9145 3.3382 3.3382 3.4574 3.4574 3.5232 3.5232 3.5877 3.5877 4.8408 4.8408 5.9440 5.9440 7.0192 7.0192 8.8451 8.8451 9.1237 9.1237 9.1914 9.1914 9.5473 9.5473 k = 0.2500 0.0198 0.0506 ( 7849 PWs) bands (ev): -17.4111 -17.4111 -15.5625 -15.5625 -12.2795 -12.2795 -11.3765 -11.3765 -11.2328 -11.2328 -9.4442 -9.4442 -9.3113 -9.3113 -6.3208 -6.3208 -5.5987 -5.5987 -5.1935 -5.1935 -3.6224 -3.6224 -3.3998 -3.3998 -2.4854 -2.4854 -2.0235 -2.0235 -1.2717 -1.2717 -1.1644 -1.1644 -0.4568 -0.4568 -0.2348 -0.2348 -0.0290 -0.0290 0.1856 0.1856 0.4447 0.4447 0.6175 0.6175 0.6767 0.6767 2.1007 2.1007 2.3552 2.3552 2.5611 2.5611 2.6641 2.6641 2.7662 2.7662 2.9094 2.9094 3.3272 3.3272 3.4417 3.4417 3.5100 3.5100 3.5782 3.5782 4.8377 4.8377 5.9441 5.9441 7.0828 7.0828 8.8158 8.8158 9.0715 9.0715 9.2018 9.2018 9.5355 9.5355 k = 0.2619 0.0207 0.0530 ( 7846 PWs) bands (ev): -17.4084 -17.4084 -15.5607 -15.5607 -12.2800 -12.2800 -11.3663 -11.3663 -11.2284 -11.2284 -9.4427 -9.4427 -9.3113 -9.3113 -6.3202 -6.3202 -5.5994 -5.5994 -5.1938 -5.1938 -3.6236 -3.6236 -3.4287 -3.4287 -2.4825 -2.4825 -2.0261 -2.0261 -1.2905 -1.2905 -1.1539 -1.1539 -0.4929 -0.4929 -0.2569 -0.2569 -0.0367 -0.0367 0.1818 0.1818 0.4575 0.4575 0.6244 0.6244 0.6832 0.6832 2.1056 2.1056 2.3433 2.3433 2.5492 2.5492 2.6574 2.6574 2.7688 2.7688 2.9052 2.9052 3.3150 3.3150 3.4255 3.4255 3.4979 3.4979 3.5690 3.5690 4.8348 4.8348 5.9435 5.9435 7.1456 7.1456 8.7835 8.7835 9.0142 9.0142 9.2165 9.2165 9.5190 9.5190 k = 0.2738 0.0217 0.0554 ( 7839 PWs) bands (ev): -17.4056 -17.4056 -15.5588 -15.5588 -12.2804 -12.2804 -11.3561 -11.3561 -11.2241 -11.2241 -9.4412 -9.4412 -9.3114 -9.3114 -6.3196 -6.3196 -5.6000 -5.6000 -5.1941 -5.1941 -3.6253 -3.6253 -3.4565 -3.4565 -2.4798 -2.4798 -2.0290 -2.0290 -1.3091 -1.3091 -1.1451 -1.1451 -0.5291 -0.5291 -0.2764 -0.2764 -0.0438 -0.0438 0.1776 0.1776 0.4701 0.4701 0.6310 0.6310 0.6899 0.6899 2.1108 2.1108 2.3316 2.3316 2.5373 2.5373 2.6512 2.6512 2.7717 2.7717 2.9021 2.9021 3.3015 3.3015 3.4087 3.4087 3.4868 3.4868 3.5602 3.5602 4.8321 4.8321 5.9423 5.9423 7.2074 7.2074 8.7482 8.7482 8.9576 8.9576 9.2320 9.2320 9.4980 9.4980 k = 0.2857 0.0226 0.0578 ( 7833 PWs) bands (ev): -17.4029 -17.4029 -15.5570 -15.5570 -12.2809 -12.2809 -11.3458 -11.3458 -11.2199 -11.2199 -9.4397 -9.4397 -9.3115 -9.3115 -6.3190 -6.3190 -5.6007 -5.6007 -5.1944 -5.1944 -3.6276 -3.6276 -3.4830 -3.4830 -2.4772 -2.4772 -2.0320 -2.0320 -1.3273 -1.3273 -1.1383 -1.1383 -0.5651 -0.5651 -0.2931 -0.2931 -0.0501 -0.0501 0.1729 0.1729 0.4826 0.4826 0.6374 0.6374 0.6968 0.6968 2.1163 2.1163 2.3205 2.3205 2.5255 2.5255 2.6453 2.6453 2.7750 2.7750 2.8998 2.8998 3.2868 3.2868 3.3912 3.3912 3.4768 3.4768 3.5517 3.5517 4.8297 4.8297 5.9405 5.9405 7.2679 7.2679 8.7097 8.7097 8.9039 8.9039 9.2476 9.2476 9.4732 9.4732 k = 0.2976 0.0236 0.0602 ( 7834 PWs) bands (ev): -17.4003 -17.4003 -15.5552 -15.5552 -12.2814 -12.2814 -11.3355 -11.3355 -11.2159 -11.2159 -9.4383 -9.4383 -9.3116 -9.3116 -6.3184 -6.3184 -5.6013 -5.6013 -5.1947 -5.1947 -3.6308 -3.6308 -3.5078 -3.5078 -2.4747 -2.4747 -2.0353 -2.0353 -1.3451 -1.3451 -1.1336 -1.1336 -0.6004 -0.6004 -0.3066 -0.3066 -0.0560 -0.0560 0.1676 0.1676 0.4947 0.4947 0.6436 0.6436 0.7039 0.7039 2.1221 2.1221 2.3098 2.3098 2.5141 2.5141 2.6397 2.6397 2.7784 2.7784 2.8985 2.8985 3.2707 3.2707 3.3732 3.3732 3.4678 3.4678 3.5437 3.5437 4.8274 4.8274 5.9382 5.9382 7.3270 7.3270 8.6681 8.6681 8.8544 8.8544 9.2630 9.2630 9.4455 9.4455 k = 0.3095 0.0245 0.0626 ( 7828 PWs) bands (ev): -17.3977 -17.3977 -15.5535 -15.5535 -12.2818 -12.2818 -11.3253 -11.3253 -11.2121 -11.2121 -9.4368 -9.4368 -9.3117 -9.3117 -6.3178 -6.3178 -5.6020 -5.6020 -5.1949 -5.1949 -3.6355 -3.6355 -3.5302 -3.5302 -2.4724 -2.4724 -2.0387 -2.0387 -1.3623 -1.3623 -1.1311 -1.1311 -0.6347 -0.6347 -0.3169 -0.3169 -0.0612 -0.0612 0.1618 0.1618 0.5064 0.5064 0.6497 0.6497 0.7111 0.7111 2.1281 2.1281 2.2998 2.2998 2.5032 2.5032 2.6344 2.6344 2.7821 2.7821 2.8981 2.8981 3.2534 3.2534 3.3548 3.3548 3.4597 3.4597 3.5362 3.5362 4.8254 4.8254 5.9354 5.9354 7.3844 7.3844 8.6239 8.6239 8.8092 8.8092 9.2779 9.2779 9.4162 9.4162 k = 0.3214 0.0254 0.0650 ( 7826 PWs) bands (ev): -17.3951 -17.3951 -15.5518 -15.5518 -12.2823 -12.2823 -11.3152 -11.3152 -11.2086 -11.2086 -9.4354 -9.4354 -9.3118 -9.3118 -6.3172 -6.3172 -5.6026 -5.6026 -5.1951 -5.1951 -3.6423 -3.6423 -3.5494 -3.5494 -2.4702 -2.4702 -2.0422 -2.0422 -1.3790 -1.3790 -1.1309 -1.1309 -0.6677 -0.6677 -0.3240 -0.3240 -0.0659 -0.0659 0.1553 0.1553 0.5175 0.5175 0.6555 0.6555 0.7185 0.7185 2.1342 2.1342 2.2904 2.2904 2.4929 2.4929 2.6294 2.6294 2.7857 2.7857 2.8986 2.8986 3.2347 3.2347 3.3363 3.3363 3.4525 3.4525 3.5293 3.5293 4.8236 4.8236 5.9322 5.9322 7.4400 7.4400 8.5780 8.5780 8.7682 8.7682 9.2915 9.2915 9.3866 9.3866 k = 0.3333 0.0264 0.0674 ( 7825 PWs) bands (ev): -17.3927 -17.3927 -15.5501 -15.5501 -12.2827 -12.2827 -11.3053 -11.3053 -11.2053 -11.2053 -9.4340 -9.4340 -9.3119 -9.3119 -6.3166 -6.3166 -5.6032 -5.6032 -5.1953 -5.1953 -3.6518 -3.6518 -3.5647 -3.5647 -2.4681 -2.4681 -2.0458 -2.0458 -1.3949 -1.3949 -1.1328 -1.1328 -0.6992 -0.6992 -0.3281 -0.3281 -0.0700 -0.0700 0.1483 0.1483 0.5279 0.5279 0.6612 0.6612 0.7260 0.7260 2.1404 2.1404 2.2817 2.2817 2.4833 2.4833 2.6246 2.6246 2.7894 2.7894 2.9002 2.9002 3.2149 3.2149 3.3177 3.3177 3.4458 3.4458 3.5230 3.5230 4.8220 4.8220 5.9287 5.9287 7.4935 7.4935 8.5314 8.5314 8.7308 8.7308 9.3018 9.3018 9.3598 9.3598 k = 0.3452 0.0273 0.0698 ( 7822 PWs) bands (ev): -17.3903 -17.3903 -15.5485 -15.5485 -12.2831 -12.2831 -11.2956 -11.2956 -11.2023 -11.2023 -9.4327 -9.4327 -9.3120 -9.3120 -6.3160 -6.3160 -5.6038 -5.6038 -5.1954 -5.1954 -3.6640 -3.6640 -3.5760 -3.5760 -2.4662 -2.4662 -2.0496 -2.0496 -1.4100 -1.4100 -1.1366 -1.1366 -0.7289 -0.7289 -0.3292 -0.3292 -0.0734 -0.0734 0.1407 0.1407 0.5375 0.5375 0.6667 0.6667 0.7335 0.7335 2.1465 2.1465 2.2737 2.2737 2.4744 2.4744 2.6203 2.6203 2.7931 2.7931 2.9029 2.9029 3.1941 3.1941 3.2991 3.2991 3.4399 3.4399 3.5172 3.5172 4.8206 4.8206 5.9249 5.9249 7.5448 7.5448 8.4852 8.4852 8.6964 8.6964 9.3002 9.3002 9.3445 9.3445 k = 0.3571 0.0283 0.0723 ( 7825 PWs) bands (ev): -17.3881 -17.3881 -15.5471 -15.5471 -12.2835 -12.2835 -11.2862 -11.2862 -11.1997 -11.1997 -9.4314 -9.4314 -9.3121 -9.3121 -6.3154 -6.3154 -5.6044 -5.6044 -5.1955 -5.1955 -3.6784 -3.6784 -3.5838 -3.5838 -2.4645 -2.4645 -2.0533 -2.0533 -1.4242 -1.4242 -1.1422 -1.1422 -0.7567 -0.7567 -0.3278 -0.3278 -0.0762 -0.0762 0.1324 0.1324 0.5464 0.5464 0.6720 0.6720 0.7411 0.7411 2.1526 2.1526 2.2665 2.2665 2.4662 2.4662 2.6163 2.6163 2.7967 2.7967 2.9067 2.9067 3.1723 3.1723 3.2807 3.2807 3.4344 3.4344 3.5120 3.5120 4.8193 4.8193 5.9210 5.9210 7.5938 7.5938 8.4401 8.4401 8.6647 8.6647 9.2806 9.2806 9.3472 9.3472 k = 0.3690 0.0292 0.0747 ( 7828 PWs) bands (ev): -17.3860 -17.3860 -15.5456 -15.5456 -12.2839 -12.2839 -11.2770 -11.2770 -11.1974 -11.1974 -9.4302 -9.4302 -9.3122 -9.3122 -6.3149 -6.3149 -5.6049 -5.6049 -5.1956 -5.1956 -3.6939 -3.6939 -3.5890 -3.5890 -2.4630 -2.4630 -2.0571 -2.0571 -1.4375 -1.4375 -1.1491 -1.1491 -0.7823 -0.7823 -0.3243 -0.3243 -0.0782 -0.0782 0.1235 0.1235 0.5544 0.5544 0.6772 0.6772 0.7485 0.7485 2.1586 2.1586 2.2600 2.2600 2.4587 2.4587 2.6128 2.6128 2.8003 2.8003 2.9116 2.9116 3.1499 3.1499 3.2624 3.2624 3.4294 3.4294 3.5074 3.5074 4.8182 4.8182 5.9171 5.9171 7.6404 7.6404 8.3965 8.3965 8.6354 8.6354 9.2553 9.2553 9.3559 9.3559 k = 0.3810 0.0302 0.0771 ( 7833 PWs) bands (ev): -17.3841 -17.3841 -15.5443 -15.5443 -12.2843 -12.2843 -11.2682 -11.2682 -11.1956 -11.1956 -9.4291 -9.4291 -9.3123 -9.3123 -6.3144 -6.3144 -5.6055 -5.6055 -5.1957 -5.1957 -3.7096 -3.7096 -3.5926 -3.5926 -2.4616 -2.4616 -2.0608 -2.0608 -1.4499 -1.4499 -1.1570 -1.1570 -0.8058 -0.8058 -0.3191 -0.3191 -0.0794 -0.0794 0.1141 0.1141 0.5615 0.5615 0.6820 0.6820 0.7558 0.7558 2.1643 2.1643 2.2543 2.2543 2.4520 2.4520 2.6098 2.6098 2.8040 2.8040 2.9175 2.9175 3.1271 3.1271 3.2445 3.2445 3.4249 3.4249 3.5034 3.5034 4.8173 4.8173 5.9131 5.9131 7.6845 7.6845 8.3547 8.3547 8.6083 8.6083 9.2299 9.2299 9.3652 9.3652 k = 0.3929 0.0311 0.0795 ( 7832 PWs) bands (ev): -17.3822 -17.3822 -15.5431 -15.5431 -12.2846 -12.2846 -11.2597 -11.2597 -11.1942 -11.1942 -9.4281 -9.4281 -9.3124 -9.3124 -6.3139 -6.3139 -5.6059 -5.6059 -5.1957 -5.1957 -3.7247 -3.7247 -3.5950 -3.5950 -2.4604 -2.4604 -2.0644 -2.0644 -1.4611 -1.4611 -1.1656 -1.1656 -0.8271 -0.8271 -0.3126 -0.3126 -0.0796 -0.0796 0.1040 0.1040 0.5678 0.5678 0.6867 0.6867 0.7628 0.7628 2.1697 2.1697 2.2493 2.2493 2.4460 2.4460 2.6073 2.6073 2.8079 2.8079 2.9244 2.9244 3.1040 3.1040 3.2268 3.2268 3.4209 3.4209 3.4998 3.4998 4.8165 4.8165 5.9093 5.9093 7.7260 7.7260 8.3151 8.3151 8.5835 8.5835 9.2058 9.2058 9.3737 9.3737 k = 0.4048 0.0320 0.0819 ( 7836 PWs) bands (ev): -17.3806 -17.3806 -15.5420 -15.5420 -12.2850 -12.2850 -11.2516 -11.2516 -11.1933 -11.1933 -9.4272 -9.4272 -9.3125 -9.3125 -6.3134 -6.3134 -5.6064 -5.6064 -5.1957 -5.1957 -3.7389 -3.7389 -3.5968 -3.5968 -2.4593 -2.4593 -2.0678 -2.0678 -1.4714 -1.4714 -1.1744 -1.1744 -0.8460 -0.8460 -0.3054 -0.3054 -0.0787 -0.0787 0.0936 0.0936 0.5732 0.5732 0.6910 0.6910 0.7695 0.7695 2.1746 2.1746 2.2451 2.2451 2.4407 2.4407 2.6053 2.6053 2.8123 2.8123 2.9321 2.9321 3.0810 3.0810 3.2096 3.2096 3.4172 3.4172 3.4968 3.4968 4.8158 4.8158 5.9056 5.9056 7.7651 7.7651 8.2776 8.2776 8.5610 8.5610 9.1837 9.1837 9.3811 9.3811 k = 0.4167 0.0330 0.0843 ( 7843 PWs) bands (ev): -17.3791 -17.3791 -15.5410 -15.5410 -12.2853 -12.2853 -11.2440 -11.2440 -11.1928 -11.1928 -9.4263 -9.4263 -9.3126 -9.3126 -6.3130 -6.3130 -5.6068 -5.6068 -5.1957 -5.1957 -3.7519 -3.7519 -3.5980 -3.5980 -2.4584 -2.4584 -2.0709 -2.0709 -1.4804 -1.4804 -1.1831 -1.1831 -0.8627 -0.8627 -0.2979 -0.2979 -0.0767 -0.0767 0.0827 0.0827 0.5779 0.5779 0.6949 0.6949 0.7757 0.7757 2.1791 2.1791 2.2415 2.2415 2.4360 2.4360 2.6038 2.6038 2.8171 2.8171 2.9405 2.9405 3.0584 3.0584 3.1929 3.1929 3.4140 3.4140 3.4942 3.4942 4.8152 4.8152 5.9022 5.9022 7.8018 7.8018 8.2422 8.2422 8.5409 8.5409 9.1638 9.1638 9.3873 9.3873 k = 0.4286 0.0339 0.0867 ( 7839 PWs) bands (ev): -17.3778 -17.3778 -15.5401 -15.5401 -12.2855 -12.2855 -11.2368 -11.2368 -11.1929 -11.1929 -9.4256 -9.4256 -9.3127 -9.3127 -6.3127 -6.3127 -5.6071 -5.6071 -5.1957 -5.1957 -3.7634 -3.7634 -3.5989 -3.5989 -2.4576 -2.4576 -2.0738 -2.0738 -1.4884 -1.4884 -1.1913 -1.1913 -0.8771 -0.8771 -0.2907 -0.2907 -0.0736 -0.0736 0.0716 0.0716 0.5819 0.5819 0.6984 0.6984 0.7813 0.7813 2.1831 2.1831 2.2385 2.2385 2.4320 2.4320 2.6027 2.6027 2.8226 2.8226 2.9492 2.9492 3.0366 3.0366 3.1769 3.1769 3.4113 3.4113 3.4920 3.4920 4.8147 4.8147 5.8991 5.8991 7.8361 7.8361 8.2089 8.2089 8.5232 8.5232 9.1462 9.1462 9.3923 9.3923 k = 0.4405 0.0349 0.0891 ( 7831 PWs) bands (ev): -17.3767 -17.3767 -15.5394 -15.5394 -12.2857 -12.2857 -11.2302 -11.2302 -11.1935 -11.1935 -9.4249 -9.4249 -9.3128 -9.3128 -6.3123 -6.3123 -5.6074 -5.6074 -5.1957 -5.1957 -3.7733 -3.7733 -3.5996 -3.5996 -2.4570 -2.4570 -2.0764 -2.0764 -1.4951 -1.4951 -1.1987 -1.1987 -0.8892 -0.8892 -0.2839 -0.2839 -0.0693 -0.0693 0.0605 0.0605 0.5851 0.5851 0.7015 0.7015 0.7862 0.7862 2.1866 2.1866 2.2361 2.2361 2.4287 2.4287 2.6019 2.6019 2.8288 2.8288 2.9580 2.9580 3.0159 3.0159 3.1619 3.1619 3.4089 3.4089 3.4903 3.4903 4.8143 4.8143 5.8964 5.8964 7.8681 7.8681 8.1776 8.1776 8.5081 8.5081 9.1313 9.1313 9.3963 9.3963 k = 0.4524 0.0358 0.0915 ( 7833 PWs) bands (ev): -17.3758 -17.3758 -15.5388 -15.5388 -12.2859 -12.2859 -11.2240 -11.2240 -11.1946 -11.1946 -9.4244 -9.4244 -9.3128 -9.3128 -6.3121 -6.3121 -5.6077 -5.6077 -5.1957 -5.1957 -3.7815 -3.7815 -3.6001 -3.6001 -2.4565 -2.4565 -2.0785 -2.0785 -1.5007 -1.5007 -1.2052 -1.2052 -0.8991 -0.8991 -0.2781 -0.2781 -0.0641 -0.0641 0.0496 0.0496 0.5877 0.5877 0.7041 0.7041 0.7904 0.7904 2.1894 2.1894 2.2342 2.2342 2.4259 2.4259 2.6015 2.6015 2.8357 2.8357 2.9661 2.9661 2.9972 2.9972 3.1482 3.1482 3.4070 3.4070 3.4889 3.4889 4.8140 4.8140 5.8941 5.8941 7.8979 7.8979 8.1484 8.1484 8.4956 8.4956 9.1189 9.1189 9.3993 9.3993 k = 0.4643 0.0368 0.0939 ( 7836 PWs) bands (ev): -17.3750 -17.3750 -15.5383 -15.5383 -12.2861 -12.2861 -11.2184 -11.2184 -11.1963 -11.1963 -9.4240 -9.4240 -9.3129 -9.3129 -6.3119 -6.3119 -5.6079 -5.6079 -5.1957 -5.1957 -3.7879 -3.7879 -3.6004 -3.6004 -2.4561 -2.4561 -2.0802 -2.0802 -1.5050 -1.5050 -1.2104 -1.2104 -0.9068 -0.9068 -0.2734 -0.2734 -0.0584 -0.0584 0.0394 0.0394 0.5897 0.5897 0.7061 0.7061 0.7937 0.7937 2.1916 2.1916 2.2327 2.2327 2.4238 2.4238 2.6013 2.6013 2.8429 2.8429 2.9697 2.9697 2.9845 2.9845 3.1362 3.1362 3.4055 3.4055 3.4878 3.4878 4.8138 4.8138 5.8922 5.8922 7.9253 7.9253 8.1214 8.1214 8.4858 8.4858 9.1092 9.1092 9.4015 9.4015 k = 0.4762 0.0377 0.0963 ( 7836 PWs) bands (ev): -17.3745 -17.3745 -15.5379 -15.5379 -12.2862 -12.2862 -11.2133 -11.2133 -11.1985 -11.1985 -9.4237 -9.4237 -9.3129 -9.3129 -6.3117 -6.3117 -5.6080 -5.6080 -5.1957 -5.1957 -3.7926 -3.7926 -3.6006 -3.6006 -2.4558 -2.4558 -2.0815 -2.0815 -1.5082 -1.5082 -1.2142 -1.2142 -0.9122 -0.9122 -0.2699 -0.2699 -0.0528 -0.0528 0.0307 0.0307 0.5911 0.5911 0.7076 0.7076 0.7961 0.7961 2.1933 2.1933 2.2317 2.2317 2.4223 2.4223 2.6011 2.6011 2.8497 2.8497 2.9612 2.9612 2.9855 2.9855 3.1267 3.1267 3.4044 3.4044 3.4870 3.4870 4.8136 4.8136 5.8909 5.8909 7.9495 7.9495 8.0975 8.0975 8.4788 8.4788 9.1023 9.1023 9.4030 9.4030 k = 0.4881 0.0386 0.0987 ( 7837 PWs) bands (ev): -17.3742 -17.3742 -15.5377 -15.5377 -12.2862 -12.2862 -11.2088 -11.2088 -11.2013 -11.2013 -9.4235 -9.4235 -9.3129 -9.3129 -6.3116 -6.3116 -5.6081 -5.6081 -5.1957 -5.1957 -3.7954 -3.7954 -3.6008 -3.6008 -2.4557 -2.4557 -2.0822 -2.0822 -1.5100 -1.5100 -1.2166 -1.2166 -0.9155 -0.9155 -0.2678 -0.2678 -0.0486 -0.0486 0.0245 0.0245 0.5919 0.5919 0.7085 0.7085 0.7976 0.7976 2.1942 2.1942 2.2311 2.2311 2.4214 2.4214 2.6011 2.6011 2.8549 2.8549 2.9523 2.9523 2.9892 2.9892 3.1205 3.1205 3.4038 3.4038 3.4866 3.4866 4.8135 4.8135 5.8901 5.8901 7.9682 7.9682 8.0790 8.0790 8.4745 8.4745 9.0981 9.0981 9.4039 9.4039 k = 0.5000 0.0396 0.1012 ( 7836 PWs) bands (ev): -17.3741 -17.3741 -15.5376 -15.5376 -12.2863 -12.2863 -11.2053 -11.2053 -11.2041 -11.2041 -9.4234 -9.4234 -9.3129 -9.3129 -6.3116 -6.3116 -5.6081 -5.6081 -5.1957 -5.1957 -3.7963 -3.7963 -3.6008 -3.6008 -2.4556 -2.4556 -2.0825 -2.0825 -1.5106 -1.5106 -1.2174 -1.2174 -0.9166 -0.9166 -0.2671 -0.2671 -0.0469 -0.0469 0.0222 0.0222 0.5922 0.5922 0.7088 0.7088 0.7981 0.7981 2.1946 2.1946 2.2309 2.2309 2.4211 2.4211 2.6011 2.6011 2.8569 2.8569 2.9489 2.9489 2.9907 2.9907 3.1183 3.1183 3.4036 3.4036 3.4864 3.4864 4.8135 4.8135 5.8898 5.8898 7.9759 7.9759 8.0713 8.0713 8.4731 8.4731 9.0967 9.0967 9.4042 9.4042 k = 0.5000-0.2428 0.0050 ( 7834 PWs) bands (ev): -17.3730 -17.3730 -15.5391 -15.5391 -12.2913 -12.2913 -11.2168 -11.2168 -11.1987 -11.1987 -9.4233 -9.4233 -9.2878 -9.2878 -6.2782 -6.2782 -5.6033 -5.6033 -5.2290 -5.2290 -3.8031 -3.8031 -3.6762 -3.6762 -2.4311 -2.4311 -2.0868 -2.0868 -1.5846 -1.5846 -1.2662 -1.2662 -0.8997 -0.8997 -0.1756 -0.1756 -0.0189 -0.0189 0.0882 0.0882 0.6099 0.6099 0.7475 0.7475 0.7656 0.7656 2.1895 2.1895 2.2178 2.2178 2.5314 2.5314 2.5730 2.5730 2.8876 2.8876 2.9059 2.9059 2.9960 2.9960 3.0552 3.0552 3.4663 3.4663 3.4812 3.4812 4.6421 4.6421 5.8863 5.8863 8.0154 8.0154 8.0806 8.0806 9.0182 9.0182 9.0540 9.0540 9.5403 9.5403 k = 0.4889-0.2374 0.0049 ( 7838 PWs) bands (ev): -17.3731 -17.3731 -15.5392 -15.5392 -12.2913 -12.2913 -11.2177 -11.2177 -11.1984 -11.1984 -9.4233 -9.4233 -9.2878 -9.2878 -6.2783 -6.2783 -5.6032 -5.6032 -5.2290 -5.2290 -3.8023 -3.8023 -3.6760 -3.6760 -2.4310 -2.4310 -2.0866 -2.0866 -1.5839 -1.5839 -1.2654 -1.2654 -0.8989 -0.8989 -0.1759 -0.1759 -0.0187 -0.0187 0.0883 0.0883 0.6098 0.6098 0.7451 0.7451 0.7672 0.7672 2.1888 2.1888 2.2184 2.2184 2.5298 2.5298 2.5748 2.5748 2.8820 2.8820 2.9126 2.9126 2.9922 2.9922 3.0598 3.0598 3.4663 3.4663 3.4812 3.4812 4.6424 4.6424 5.8865 5.8865 8.0095 8.0095 8.0855 8.0855 9.0179 9.0179 9.0552 9.0552 9.5402 9.5402 k = 0.4778-0.2320 0.0048 ( 7837 PWs) bands (ev): -17.3734 -17.3734 -15.5394 -15.5394 -12.2913 -12.2913 -11.2200 -11.2200 -11.1974 -11.1974 -9.4234 -9.4234 -9.2878 -9.2878 -6.2787 -6.2787 -5.6032 -5.6032 -5.2291 -5.2291 -3.7999 -3.7999 -3.6755 -3.6755 -2.4309 -2.4309 -2.0860 -2.0860 -1.5820 -1.5820 -1.2631 -1.2631 -0.8967 -0.8967 -0.1769 -0.1769 -0.0183 -0.0183 0.0885 0.0885 0.6095 0.6095 0.7392 0.7392 0.7705 0.7705 2.1869 2.1869 2.2197 2.2197 2.5257 2.5257 2.5794 2.5794 2.8729 2.8729 2.9250 2.9250 2.9836 2.9836 3.0713 3.0713 3.4664 3.4664 3.4812 3.4812 4.6433 4.6433 5.8872 5.8872 7.9949 7.9949 8.0973 8.0973 9.0170 9.0170 9.0588 9.0588 9.5399 9.5399 k = 0.4667-0.2266 0.0047 ( 7842 PWs) bands (ev): -17.3738 -17.3738 -15.5396 -15.5396 -12.2913 -12.2913 -11.2234 -11.2234 -11.1963 -11.1963 -9.4235 -9.4235 -9.2879 -9.2879 -6.2794 -6.2794 -5.6032 -5.6032 -5.2293 -5.2293 -3.7958 -3.7958 -3.6745 -3.6745 -2.4307 -2.4307 -2.0851 -2.0851 -1.5788 -1.5788 -1.2593 -1.2593 -0.8929 -0.8929 -0.1785 -0.1785 -0.0174 -0.0174 0.0889 0.0889 0.6089 0.6089 0.7316 0.7316 0.7738 0.7738 2.1841 2.1841 2.2218 2.2218 2.5202 2.5202 2.5858 2.5858 2.8640 2.8640 2.9383 2.9383 2.9743 2.9743 3.0862 3.0862 3.4666 3.4666 3.4813 3.4813 4.6448 4.6448 5.8884 5.8884 7.9755 7.9755 8.1120 8.1120 9.0158 9.0158 9.0645 9.0645 9.5393 9.5393 k = 0.4556-0.2212 0.0046 ( 7842 PWs) bands (ev): -17.3745 -17.3745 -15.5401 -15.5401 -12.2913 -12.2913 -11.2276 -11.2276 -11.1954 -11.1954 -9.4237 -9.4237 -9.2881 -9.2881 -6.2803 -6.2803 -5.6032 -5.6032 -5.2295 -5.2295 -3.7902 -3.7902 -3.6732 -3.6732 -2.4305 -2.4305 -2.0838 -2.0838 -1.5744 -1.5744 -1.2540 -1.2540 -0.8876 -0.8876 -0.1807 -0.1807 -0.0162 -0.0162 0.0894 0.0894 0.6081 0.6081 0.7229 0.7229 0.7766 0.7766 2.1805 2.1805 2.2243 2.2243 2.5143 2.5143 2.5930 2.5930 2.8558 2.8558 2.9470 2.9470 2.9709 2.9709 3.1030 3.1030 3.4669 3.4669 3.4814 3.4814 4.6469 4.6469 5.8900 5.8900 7.9528 7.9528 8.1283 8.1283 9.0148 9.0148 9.0720 9.0720 9.5384 9.5384 k = 0.4444-0.2158 0.0045 ( 7846 PWs) bands (ev): -17.3753 -17.3753 -15.5406 -15.5406 -12.2913 -12.2913 -11.2324 -11.2324 -11.1947 -11.1947 -9.4239 -9.4239 -9.2883 -9.2883 -6.2814 -6.2814 -5.6031 -5.6031 -5.2298 -5.2298 -3.7831 -3.7831 -3.6715 -3.6715 -2.4302 -2.4302 -2.0821 -2.0821 -1.5686 -1.5686 -1.2474 -1.2474 -0.8808 -0.8808 -0.1835 -0.1835 -0.0146 -0.0146 0.0900 0.0900 0.6069 0.6069 0.7135 0.7135 0.7787 0.7787 2.1764 2.1764 2.2272 2.2272 2.5086 2.5086 2.6007 2.6007 2.8482 2.8482 2.9430 2.9430 2.9821 2.9821 3.1207 3.1207 3.4672 3.4672 3.4817 3.4817 4.6495 4.6495 5.8921 5.8921 7.9274 7.9274 8.1459 8.1459 9.0140 9.0140 9.0813 9.0813 9.5372 9.5372 k = 0.4333-0.2104 0.0044 ( 7848 PWs) bands (ev): -17.3763 -17.3763 -15.5412 -15.5412 -12.2913 -12.2913 -11.2377 -11.2377 -11.1943 -11.1943 -9.4242 -9.4242 -9.2885 -9.2885 -6.2827 -6.2827 -5.6031 -5.6031 -5.2301 -5.2301 -3.7745 -3.7745 -3.6693 -3.6693 -2.4300 -2.4300 -2.0800 -2.0800 -1.5617 -1.5617 -1.2396 -1.2396 -0.8722 -0.8722 -0.1868 -0.1868 -0.0126 -0.0126 0.0907 0.0907 0.6055 0.6055 0.7034 0.7034 0.7800 0.7800 2.1718 2.1718 2.2303 2.2303 2.5033 2.5033 2.6086 2.6086 2.8411 2.8411 2.9346 2.9346 2.9997 2.9997 3.1391 3.1391 3.4675 3.4675 3.4822 3.4822 4.6528 4.6528 5.8945 5.8945 7.8996 7.8996 8.1647 8.1647 9.0137 9.0137 9.0921 9.0921 9.5357 9.5357 k = 0.4222-0.2050 0.0043 ( 7845 PWs) bands (ev): -17.3774 -17.3774 -15.5420 -15.5420 -12.2913 -12.2913 -11.2434 -11.2434 -11.1944 -11.1944 -9.4246 -9.4246 -9.2888 -9.2888 -6.2843 -6.2843 -5.6030 -5.6030 -5.2304 -5.2304 -3.7647 -3.7647 -3.6666 -3.6666 -2.4297 -2.4297 -2.0776 -2.0776 -1.5536 -1.5536 -1.2308 -1.2308 -0.8620 -0.8620 -0.1905 -0.1905 -0.0100 -0.0100 0.0914 0.0914 0.6036 0.6036 0.6928 0.6928 0.7804 0.7804 2.1670 2.1670 2.2337 2.2337 2.4987 2.4987 2.6167 2.6167 2.8343 2.8343 2.9262 2.9262 3.0194 3.0194 3.1579 3.1579 3.4678 3.4678 3.4830 3.4830 4.6566 4.6566 5.8973 5.8973 7.8694 7.8694 8.1850 8.1850 9.0139 9.0139 9.1046 9.1046 9.5338 9.5338 k = 0.4111-0.1996 0.0042 ( 7849 PWs) bands (ev): -17.3787 -17.3787 -15.5428 -15.5428 -12.2912 -12.2912 -11.2495 -11.2495 -11.1949 -11.1949 -9.4250 -9.4250 -9.2891 -9.2891 -6.2860 -6.2860 -5.6029 -5.6029 -5.2307 -5.2307 -3.7537 -3.7537 -3.6632 -3.6632 -2.4296 -2.4296 -2.0749 -2.0749 -1.5443 -1.5443 -1.2211 -1.2211 -0.8500 -0.8500 -0.1945 -0.1945 -0.0071 -0.0071 0.0921 0.0921 0.6012 0.6012 0.6821 0.6821 0.7800 0.7800 2.1618 2.1618 2.2374 2.2374 2.4949 2.4949 2.6247 2.6247 2.8277 2.8277 2.9187 2.9187 3.0401 3.0401 3.1769 3.1769 3.4681 3.4681 3.4842 3.4842 4.6609 4.6609 5.9004 5.9004 7.8368 7.8368 8.2071 8.2071 9.0149 9.0149 9.1185 9.1185 9.5317 9.5317 k = 0.4000-0.1942 0.0040 ( 7849 PWs) bands (ev): -17.3802 -17.3802 -15.5438 -15.5438 -12.2912 -12.2912 -11.2560 -11.2560 -11.1958 -11.1958 -9.4254 -9.4254 -9.2894 -9.2894 -6.2878 -6.2878 -5.6028 -5.6028 -5.2310 -5.2310 -3.7420 -3.7420 -3.6590 -3.6590 -2.4295 -2.4295 -2.0719 -2.0719 -1.5339 -1.5339 -1.2109 -1.2109 -0.8362 -0.8362 -0.1986 -0.1986 -0.0037 -0.0037 0.0928 0.0928 0.5980 0.5980 0.6713 0.6713 0.7788 0.7788 2.1564 2.1564 2.2415 2.2415 2.4920 2.4920 2.6329 2.6329 2.8212 2.8212 2.9124 2.9124 3.0616 3.0616 3.1960 3.1960 3.4685 3.4685 3.4859 3.4859 4.6656 4.6656 5.9037 5.9037 7.8019 7.8019 8.2312 8.2312 9.0166 9.0166 9.1339 9.1339 9.5292 9.5292 k = 0.3889-0.1888 0.0039 ( 7849 PWs) bands (ev): -17.3818 -17.3818 -15.5448 -15.5448 -12.2912 -12.2912 -11.2628 -11.2628 -11.1971 -11.1971 -9.4259 -9.4259 -9.2898 -9.2898 -6.2898 -6.2898 -5.6027 -5.6027 -5.2313 -5.2313 -3.7298 -3.7298 -3.6536 -3.6536 -2.4295 -2.4295 -2.0687 -2.0687 -1.5224 -1.5224 -1.2002 -1.2002 -0.8205 -0.8205 -0.2028 -0.2028 0.0001 0.0001 0.0935 0.0935 0.5939 0.5939 0.6608 0.6608 0.7767 0.7767 2.1508 2.1508 2.2459 2.2459 2.4901 2.4901 2.6409 2.6409 2.8147 2.8147 2.9074 2.9074 3.0836 3.0836 3.2150 3.2150 3.4690 3.4690 3.4881 3.4881 4.6709 4.6709 5.9072 5.9072 7.7647 7.7647 8.2576 8.2576 9.0193 9.0193 9.1504 9.1504 9.5268 9.5268 k = 0.3778-0.1835 0.0038 ( 7843 PWs) bands (ev): -17.3836 -17.3836 -15.5460 -15.5460 -12.2911 -12.2911 -11.2699 -11.2699 -11.1989 -11.1989 -9.4265 -9.4265 -9.2902 -9.2902 -6.2919 -6.2919 -5.6026 -5.6026 -5.2315 -5.2315 -3.7179 -3.7179 -3.6464 -3.6464 -2.4297 -2.4297 -2.0652 -2.0652 -1.5099 -1.5099 -1.1895 -1.1895 -0.8028 -0.8028 -0.2067 -0.2067 0.0044 0.0044 0.0942 0.0942 0.5886 0.5886 0.6509 0.6509 0.7740 0.7740 2.1452 2.1452 2.2508 2.2508 2.4893 2.4893 2.6490 2.6490 2.8083 2.8083 2.9035 2.9035 3.1056 3.1056 3.2340 3.2340 3.4697 3.4697 3.4908 3.4908 4.6766 4.6766 5.9109 5.9109 7.7253 7.7253 8.2865 8.2865 9.0228 9.0228 9.1680 9.1680 9.5244 9.5244 k = 0.3667-0.1781 0.0037 ( 7844 PWs) bands (ev): -17.3854 -17.3854 -15.5472 -15.5472 -12.2910 -12.2910 -11.2773 -11.2773 -11.2011 -11.2011 -9.4272 -9.4272 -9.2907 -9.2907 -6.2941 -6.2941 -5.6024 -5.6024 -5.2317 -5.2317 -3.7068 -3.7068 -3.6369 -3.6369 -2.4301 -2.4301 -2.0615 -2.0615 -1.4964 -1.4964 -1.1789 -1.1789 -0.7832 -0.7832 -0.2102 -0.2102 0.0089 0.0089 0.0950 0.0950 0.5818 0.5818 0.6421 0.6421 0.7705 0.7705 2.1394 2.1394 2.2562 2.2562 2.4895 2.4895 2.6570 2.6570 2.8020 2.8020 2.9007 2.9007 3.1276 3.1276 3.2529 3.2529 3.4707 3.4707 3.4941 3.4941 4.6827 4.6827 5.9146 5.9146 7.6838 7.6838 8.3182 8.3182 9.0274 9.0274 9.1862 9.1862 9.5225 9.5225 k = 0.3556-0.1727 0.0036 ( 7844 PWs) bands (ev): -17.3874 -17.3874 -15.5485 -15.5485 -12.2909 -12.2909 -11.2849 -11.2849 -11.2036 -11.2036 -9.4279 -9.4279 -9.2911 -9.2911 -6.2963 -6.2963 -5.6022 -5.6022 -5.2317 -5.2317 -3.6972 -3.6972 -3.6246 -3.6246 -2.4307 -2.4307 -2.0577 -2.0577 -1.4820 -1.4820 -1.1688 -1.1688 -0.7616 -0.7616 -0.2131 -0.2131 0.0137 0.0137 0.0959 0.0959 0.5732 0.5732 0.6344 0.6344 0.7663 0.7663 2.1337 2.1337 2.2621 2.2621 2.4907 2.4907 2.6650 2.6650 2.7958 2.7958 2.8989 2.8989 3.1492 3.1492 3.2716 3.2716 3.4721 3.4721 3.4980 3.4980 4.6891 4.6891 5.9183 5.9183 7.6402 7.6402 8.3526 8.3526 9.0331 9.0331 9.2046 9.2046 9.5215 9.5215 k = 0.3444-0.1673 0.0035 ( 7839 PWs) bands (ev): -17.3896 -17.3896 -15.5499 -15.5499 -12.2907 -12.2907 -11.2928 -11.2928 -11.2065 -11.2065 -9.4287 -9.4287 -9.2917 -9.2917 -6.2985 -6.2985 -5.6020 -5.6020 -5.2317 -5.2317 -3.6894 -3.6894 -3.6092 -3.6092 -2.4316 -2.4316 -2.0538 -2.0538 -1.4667 -1.4667 -1.1595 -1.1595 -0.7381 -0.7381 -0.2151 -0.2151 0.0188 0.0188 0.0969 0.0969 0.5631 0.5631 0.6279 0.6279 0.7615 0.7615 2.1280 2.1280 2.2686 2.2686 2.4930 2.4930 2.6729 2.6729 2.7898 2.7898 2.8980 2.8980 3.1702 3.1702 3.2902 3.2902 3.4739 3.4739 3.5024 3.5024 4.6959 4.6959 5.9219 5.9219 7.5946 7.5946 8.3900 8.3900 9.0401 9.0401 9.2226 9.2226 9.5220 9.5220 k = 0.3333-0.1619 0.0034 ( 7841 PWs) bands (ev): -17.3918 -17.3918 -15.5513 -15.5513 -12.2906 -12.2906 -11.3009 -11.3009 -11.2098 -11.2098 -9.4296 -9.4296 -9.2922 -9.2922 -6.3007 -6.3007 -5.6018 -5.6018 -5.2315 -5.2315 -3.6832 -3.6832 -3.5911 -3.5911 -2.4328 -2.4328 -2.0498 -2.0498 -1.4506 -1.4506 -1.1511 -1.1511 -0.7128 -0.7128 -0.2159 -0.2159 0.0239 0.0239 0.0980 0.0980 0.5517 0.5517 0.6224 0.6224 0.7562 0.7562 2.1223 2.1223 2.2756 2.2756 2.4962 2.4962 2.6807 2.6807 2.7843 2.7843 2.8977 2.8977 3.1903 3.1903 3.3088 3.3088 3.4763 3.4763 3.5075 3.5075 4.7030 4.7030 5.9254 5.9254 7.5472 7.5472 8.4304 8.4304 9.0484 9.0484 9.2395 9.2395 9.5245 9.5245 k = 0.3222-0.1565 0.0033 ( 7836 PWs) bands (ev): -17.3941 -17.3941 -15.5528 -15.5528 -12.2903 -12.2903 -11.3091 -11.3091 -11.2133 -11.2133 -9.4305 -9.4305 -9.2928 -9.2928 -6.3029 -6.3029 -5.6016 -5.6016 -5.2311 -5.2311 -3.6783 -3.6783 -3.5706 -3.5706 -2.4342 -2.4342 -2.0458 -2.0458 -1.4337 -1.4337 -1.1440 -1.1440 -0.6856 -0.6856 -0.2153 -0.2153 0.0291 0.0291 0.0995 0.0995 0.5392 0.5392 0.6175 0.6175 0.7503 0.7503 2.1169 2.1169 2.2833 2.2833 2.5003 2.5003 2.6883 2.6883 2.7791 2.7791 2.8982 2.8982 3.2093 3.2093 3.3273 3.3273 3.4793 3.4793 3.5132 3.5132 4.7103 4.7103 5.9287 5.9287 7.4979 7.4979 8.4735 8.4735 9.0581 9.0581 9.2546 9.2546 9.5298 9.5298 k = 0.3111-0.1511 0.0031 ( 7840 PWs) bands (ev): -17.3965 -17.3965 -15.5543 -15.5543 -12.2901 -12.2901 -11.3175 -11.3175 -11.2170 -11.2170 -9.4315 -9.4315 -9.2935 -9.2935 -6.3051 -6.3051 -5.6013 -5.6013 -5.2307 -5.2307 -3.6741 -3.6741 -3.5482 -3.5482 -2.4360 -2.4360 -2.0419 -2.0419 -1.4162 -1.4162 -1.1383 -1.1383 -0.6570 -0.6570 -0.2132 -0.2132 0.0343 0.0343 0.1012 0.1012 0.5261 0.5261 0.6130 0.6130 0.7441 0.7441 2.1116 2.1116 2.2916 2.2916 2.5053 2.5053 2.6957 2.6957 2.7745 2.7745 2.8992 2.8992 3.2271 3.2271 3.3458 3.3458 3.4829 3.4829 3.5195 3.5195 4.7178 4.7178 5.9317 5.9317 7.4468 7.4468 8.5194 8.5194 9.0696 9.0696 9.2670 9.2670 9.5385 9.5385 k = 0.3000-0.1457 0.0030 ( 7838 PWs) bands (ev): -17.3989 -17.3989 -15.5559 -15.5559 -12.2898 -12.2898 -11.3261 -11.3261 -11.2210 -11.2210 -9.4326 -9.4326 -9.2941 -9.2941 -6.3072 -6.3072 -5.6010 -5.6010 -5.2300 -5.2300 -3.6706 -3.6706 -3.5244 -3.5244 -2.4381 -2.4381 -2.0381 -2.0381 -1.3981 -1.3981 -1.1343 -1.1343 -0.6269 -0.6269 -0.2091 -0.2091 0.0393 0.0393 0.1034 0.1034 0.5125 0.5125 0.6087 0.6087 0.7374 0.7374 2.1065 2.1065 2.3004 2.3004 2.5111 2.5111 2.7028 2.7028 2.7705 2.7705 2.9007 2.9007 3.2434 3.2434 3.3643 3.3643 3.4873 3.4873 3.5264 3.5264 4.7254 4.7254 5.9344 5.9344 7.3942 7.3942 8.5675 8.5675 9.0831 9.0831 9.2762 9.2762 9.5508 9.5508 k = 0.2889-0.1403 0.0029 ( 7833 PWs) bands (ev): -17.4014 -17.4014 -15.5575 -15.5575 -12.2895 -12.2895 -11.3348 -11.3348 -11.2251 -11.2251 -9.4337 -9.4337 -9.2948 -9.2948 -6.3092 -6.3092 -5.6007 -5.6007 -5.2292 -5.2292 -3.6675 -3.6675 -3.4993 -3.4993 -2.4406 -2.4406 -2.0344 -2.0344 -1.3796 -1.3796 -1.1322 -1.1322 -0.5956 -0.5956 -0.2031 -0.2031 0.0442 0.0442 0.1061 0.1061 0.4988 0.4988 0.6044 0.6044 0.7305 0.7305 2.1017 2.1017 2.3099 2.3099 2.5175 2.5175 2.7096 2.7096 2.7672 2.7672 2.9029 2.9029 3.2584 3.2584 3.3827 3.3827 3.4925 3.4925 3.5339 3.5339 4.7333 4.7333 5.9367 5.9367 7.3400 7.3400 8.6173 8.6173 9.0988 9.0988 9.2822 9.2822 9.5651 9.5651 k = 0.2778-0.1349 0.0028 ( 7827 PWs) bands (ev): -17.4040 -17.4040 -15.5592 -15.5592 -12.2891 -12.2891 -11.3437 -11.3437 -11.2293 -11.2293 -9.4349 -9.4349 -9.2955 -9.2955 -6.3111 -6.3111 -5.6004 -5.6004 -5.2282 -5.2282 -3.6647 -3.6647 -3.4732 -3.4732 -2.4433 -2.4433 -2.0308 -2.0308 -1.3606 -1.3606 -1.1319 -1.1319 -0.5635 -0.5635 -0.1949 -0.1949 0.0489 0.0489 0.1093 0.1093 0.4850 0.4850 0.6000 0.6000 0.7233 0.7233 2.0972 2.0972 2.3198 2.3198 2.5246 2.5246 2.7160 2.7160 2.7648 2.7648 2.9056 2.9056 3.2721 3.2721 3.4010 3.4010 3.4986 3.4986 3.5418 3.5418 4.7412 4.7412 5.9385 5.9385 7.2843 7.2843 8.6680 8.6680 9.1173 9.1173 9.2850 9.2850 9.5556 9.5556 k = 0.2667-0.1295 0.0027 ( 7830 PWs) bands (ev): -17.4065 -17.4065 -15.5608 -15.5608 -12.2887 -12.2887 -11.3526 -11.3526 -11.2336 -11.2336 -9.4362 -9.4362 -9.2963 -9.2963 -6.3129 -6.3129 -5.6000 -5.6000 -5.2271 -5.2271 -3.6621 -3.6621 -3.4462 -3.4462 -2.4464 -2.4464 -2.0275 -2.0275 -1.3414 -1.3414 -1.1335 -1.1335 -0.5308 -0.5308 -0.1844 -0.1844 0.0534 0.0534 0.1131 0.1131 0.4714 0.4714 0.5954 0.5954 0.7159 0.7159 2.0931 2.0931 2.3302 2.3302 2.5321 2.5321 2.7217 2.7217 2.7632 2.7632 2.9090 2.9090 3.2845 3.2845 3.4190 3.4190 3.5057 3.5057 3.5501 3.5501 4.7492 4.7492 5.9399 5.9399 7.2274 7.2274 8.7186 8.7186 9.1391 9.1391 9.2854 9.2854 9.5164 9.5164 k = 0.2556-0.1241 0.0026 ( 7838 PWs) bands (ev): -17.4091 -17.4091 -15.5625 -15.5625 -12.2882 -12.2882 -11.3616 -11.3616 -11.2379 -11.2379 -9.4375 -9.4375 -9.2971 -9.2971 -6.3146 -6.3146 -5.5996 -5.5996 -5.2257 -5.2257 -3.6596 -3.6596 -3.4186 -3.4186 -2.4497 -2.4497 -2.0244 -2.0244 -1.3221 -1.3221 -1.1370 -1.1370 -0.4978 -0.4978 -0.1717 -0.1717 0.0577 0.0577 0.1174 0.1174 0.4579 0.4579 0.5906 0.5906 0.7085 0.7085 2.0892 2.0892 2.3411 2.3411 2.5399 2.5399 2.7265 2.7265 2.7627 2.7627 2.9131 2.9131 3.2958 3.2958 3.4365 3.4365 3.5138 3.5138 3.5588 3.5588 4.7572 4.7572 5.9407 5.9407 7.1692 7.1692 8.7677 8.7677 9.1645 9.1645 9.2842 9.2842 9.4743 9.4743 k = 0.2444-0.1187 0.0025 ( 7840 PWs) bands (ev): -17.4117 -17.4117 -15.5642 -15.5642 -12.2876 -12.2876 -11.3707 -11.3707 -11.2423 -11.2423 -9.4389 -9.4389 -9.2979 -9.2979 -6.3162 -6.3162 -5.5992 -5.5992 -5.2242 -5.2242 -3.6572 -3.6572 -3.3905 -3.3905 -2.4534 -2.4534 -2.0215 -2.0215 -1.3028 -1.3028 -1.1423 -1.1423 -0.4648 -0.4648 -0.1568 -0.1568 0.0621 0.0621 0.1222 0.1222 0.4448 0.4448 0.5855 0.5855 0.7010 0.7010 2.0857 2.0857 2.3523 2.3523 2.5480 2.5480 2.7304 2.7304 2.7635 2.7635 2.9180 2.9180 3.3061 3.3061 3.4534 3.4534 3.5231 3.5231 3.5677 3.5677 4.7653 4.7653 5.9410 5.9410 7.1100 7.1100 8.8135 8.8135 9.1931 9.1931 9.2830 9.2830 9.4310 9.4310 k = 0.2333-0.1133 0.0024 ( 7834 PWs) bands (ev): -17.4143 -17.4143 -15.5658 -15.5658 -12.2871 -12.2871 -11.3798 -11.3798 -11.2465 -11.2465 -9.4403 -9.4403 -9.2987 -9.2987 -6.3177 -6.3177 -5.5988 -5.5988 -5.2225 -5.2225 -3.6548 -3.6548 -3.3621 -3.3621 -2.4573 -2.4573 -2.0189 -2.0189 -1.2837 -1.2837 -1.1491 -1.1491 -0.4324 -0.4324 -0.1398 -0.1398 0.0664 0.0664 0.1275 0.1275 0.4320 0.4320 0.5800 0.5800 0.6936 0.6936 2.0825 2.0825 2.3638 2.3638 2.5561 2.5561 2.7333 2.7333 2.7655 2.7655 2.9240 2.9240 3.3157 3.3157 3.4696 3.4696 3.5334 3.5334 3.5767 3.5767 4.7734 4.7734 5.9408 5.9408 7.0499 7.0499 8.8545 8.8545 9.2205 9.2205 9.2862 9.2862 9.3873 9.3873 k = 0.2222-0.1079 0.0022 ( 7830 PWs) bands (ev): -17.4169 -17.4169 -15.5675 -15.5675 -12.2864 -12.2864 -11.3889 -11.3889 -11.2508 -11.2508 -9.4418 -9.4418 -9.2995 -9.2995 -6.3190 -6.3190 -5.5983 -5.5983 -5.2207 -5.2207 -3.6525 -3.6525 -3.3335 -3.3335 -2.4615 -2.4615 -2.0165 -2.0165 -1.2654 -1.2654 -1.1569 -1.1569 -0.4007 -0.4007 -0.1209 -0.1209 0.0710 0.0710 0.1333 0.1333 0.4197 0.4197 0.5743 0.5743 0.6862 0.6862 2.0797 2.0797 2.3755 2.3755 2.5641 2.5641 2.7353 2.7353 2.7686 2.7686 2.9310 2.9310 3.3245 3.3245 3.4851 3.4851 3.5448 3.5448 3.5860 3.5860 4.7815 4.7815 5.9400 5.9400 6.9890 6.9890 8.8893 8.8893 9.2336 9.2336 9.3029 9.3029 9.3471 9.3471 k = 0.2111-0.1025 0.0021 ( 7837 PWs) bands (ev): -17.4194 -17.4194 -15.5691 -15.5691 -12.2858 -12.2858 -11.3979 -11.3979 -11.2549 -11.2549 -9.4433 -9.4433 -9.3004 -9.3004 -6.3203 -6.3203 -5.5978 -5.5978 -5.2187 -5.2187 -3.6502 -3.6502 -3.3048 -3.3048 -2.4658 -2.4658 -2.0144 -2.0144 -1.2486 -1.2486 -1.1649 -1.1649 -0.3702 -0.3702 -0.1004 -0.1004 0.0758 0.0758 0.1394 0.1394 0.4080 0.4080 0.5683 0.5683 0.6791 0.6791 2.0771 2.0771 2.3873 2.3873 2.5719 2.5719 2.7366 2.7366 2.7723 2.7723 2.9394 2.9394 3.3327 3.3327 3.4999 3.4999 3.5571 3.5571 3.5953 3.5953 4.7896 4.7896 5.9387 5.9387 6.9276 6.9276 8.9169 8.9169 9.2244 9.2244 9.2989 9.2989 9.3514 9.3514 k = 0.2000-0.0971 0.0020 ( 7836 PWs) bands (ev): -17.4219 -17.4219 -15.5707 -15.5707 -12.2851 -12.2851 -11.4068 -11.4068 -11.2589 -11.2589 -9.4448 -9.4448 -9.3012 -9.3012 -6.3214 -6.3214 -5.5973 -5.5973 -5.2166 -5.2166 -3.6479 -3.6479 -3.2763 -3.2763 -2.4703 -2.4703 -2.0125 -2.0125 -1.2352 -1.2352 -1.1711 -1.1711 -0.3411 -0.3411 -0.0784 -0.0784 0.0811 0.0811 0.1458 0.1458 0.3969 0.3969 0.5620 0.5620 0.6722 0.6722 2.0750 2.0750 2.3992 2.3992 2.5793 2.5793 2.7375 2.7375 2.7764 2.7764 2.9491 2.9491 3.3403 3.3403 3.5142 3.5142 3.5699 3.5699 3.6048 3.6048 4.7976 4.7976 5.9368 5.9368 6.8658 6.8658 8.9365 8.9365 9.1937 9.1937 9.2778 9.2778 9.3933 9.3933 k = 0.1889-0.0917 0.0019 ( 7832 PWs) bands (ev): -17.4243 -17.4243 -15.5723 -15.5723 -12.2843 -12.2843 -11.4156 -11.4156 -11.2627 -11.2627 -9.4463 -9.4463 -9.3021 -9.3021 -6.3223 -6.3223 -5.5968 -5.5968 -5.2144 -5.2144 -3.6455 -3.6455 -3.2480 -3.2480 -2.4749 -2.4749 -2.0108 -2.0108 -1.2291 -1.2291 -1.1713 -1.1713 -0.3139 -0.3139 -0.0554 -0.0554 0.0868 0.0868 0.1526 0.1526 0.3865 0.3865 0.5555 0.5555 0.6656 0.6656 2.0731 2.0731 2.4110 2.4110 2.5862 2.5862 2.7382 2.7382 2.7807 2.7807 2.9604 2.9604 3.3473 3.3473 3.5281 3.5281 3.5830 3.5830 3.6144 3.6144 4.8055 4.8055 5.9344 5.9344 6.8038 6.8038 8.9470 8.9470 9.1487 9.1487 9.2675 9.2675 9.4351 9.4351 k = 0.1778-0.0863 0.0018 ( 7835 PWs) bands (ev): -17.4267 -17.4267 -15.5738 -15.5738 -12.2835 -12.2835 -11.4243 -11.4243 -11.2664 -11.2664 -9.4479 -9.4479 -9.3029 -9.3029 -6.3232 -6.3232 -5.5963 -5.5963 -5.2121 -5.2121 -3.6431 -3.6431 -3.2201 -3.2201 -2.4796 -2.4796 -2.0093 -2.0093 -1.2327 -1.2327 -1.1632 -1.1632 -0.2888 -0.2888 -0.0317 -0.0317 0.0929 0.0929 0.1597 0.1597 0.3769 0.3769 0.5489 0.5489 0.6593 0.6593 2.0715 2.0715 2.4227 2.4227 2.5925 2.5925 2.7389 2.7389 2.7849 2.7849 2.9733 2.9733 3.3537 3.3537 3.5418 3.5418 3.5962 3.5962 3.6243 3.6243 4.8134 4.8134 5.9316 5.9316 6.7420 6.7420 8.9449 8.9449 9.1016 9.1016 9.2631 9.2631 9.4691 9.4691 k = 0.1667-0.0809 0.0017 ( 7838 PWs) bands (ev): -17.4289 -17.4289 -15.5752 -15.5752 -12.2827 -12.2827 -11.4328 -11.4328 -11.2698 -11.2698 -9.4494 -9.4494 -9.3038 -9.3038 -6.3240 -6.3240 -5.5958 -5.5958 -5.2098 -5.2098 -3.6407 -3.6407 -3.1928 -3.1928 -2.4844 -2.4844 -2.0080 -2.0080 -1.2427 -1.2427 -1.1498 -1.1498 -0.2659 -0.2659 -0.0078 -0.0078 0.0995 0.0995 0.1671 0.1671 0.3681 0.3681 0.5421 0.5421 0.6535 0.6535 2.0703 2.0703 2.4341 2.4341 2.5980 2.5980 2.7394 2.7394 2.7889 2.7889 2.9878 2.9878 3.3595 3.3595 3.5550 3.5550 3.6092 3.6092 3.6346 3.6346 4.8211 4.8211 5.9284 5.9284 6.6805 6.6805 8.9238 8.9238 9.0631 9.0631 9.2621 9.2621 9.4915 9.4915 k = 0.1556-0.0755 0.0016 ( 7833 PWs) bands (ev): -17.4311 -17.4311 -15.5766 -15.5766 -12.2819 -12.2819 -11.4410 -11.4410 -11.2731 -11.2731 -9.4509 -9.4509 -9.3046 -9.3046 -6.3246 -6.3246 -5.5952 -5.5952 -5.2074 -5.2074 -3.6383 -3.6383 -3.1662 -3.1662 -2.4891 -2.4891 -2.0069 -2.0069 -1.2557 -1.2557 -1.1345 -1.1345 -0.2454 -0.2454 0.0158 0.0158 0.1066 0.1066 0.1749 0.1749 0.3603 0.3603 0.5354 0.5354 0.6482 0.6482 2.0692 2.0692 2.4453 2.4453 2.6028 2.6028 2.7400 2.7400 2.7927 2.7927 3.0039 3.0039 3.3646 3.3646 3.5676 3.5676 3.6222 3.6222 3.6454 3.6454 4.8286 4.8286 5.9249 5.9249 6.6197 6.6197 8.8804 8.8804 9.0388 9.0388 9.2637 9.2637 9.5021 9.5021 k = 0.1444-0.0701 0.0015 ( 7834 PWs) bands (ev): -17.4332 -17.4332 -15.5780 -15.5780 -12.2811 -12.2811 -11.4489 -11.4489 -11.2762 -11.2762 -9.4524 -9.4524 -9.3054 -9.3054 -6.3252 -6.3252 -5.5947 -5.5947 -5.2050 -5.2050 -3.6359 -3.6359 -3.1405 -3.1405 -2.4938 -2.4938 -2.0058 -2.0058 -1.2700 -1.2700 -1.1188 -1.1188 -0.2273 -0.2273 0.0386 0.0386 0.1140 0.1140 0.1831 0.1831 0.3533 0.3533 0.5287 0.5287 0.6434 0.6434 2.0684 2.0684 2.4561 2.4561 2.6067 2.6067 2.7406 2.7406 2.7962 2.7962 3.0215 3.0215 3.3690 3.3690 3.5792 3.5792 3.6351 3.6351 3.6569 3.6569 4.8360 4.8360 5.9211 5.9211 6.5599 6.5599 8.8218 8.8218 9.0236 9.0236 9.2674 9.2674 9.5033 9.5033 k = 0.1333-0.0647 0.0013 ( 7837 PWs) bands (ev): -17.4352 -17.4352 -15.5792 -15.5792 -12.2803 -12.2803 -11.4564 -11.4564 -11.2790 -11.2790 -9.4538 -9.4538 -9.3062 -9.3062 -6.3257 -6.3257 -5.5942 -5.5942 -5.2027 -5.2027 -3.6336 -3.6336 -3.1159 -3.1159 -2.4984 -2.4984 -2.0050 -2.0050 -1.2848 -1.2848 -1.1032 -1.1032 -0.2116 -0.2116 0.0600 0.0600 0.1218 0.1218 0.1916 0.1916 0.3474 0.3474 0.5221 0.5221 0.6391 0.6391 2.0678 2.0678 2.4665 2.4665 2.6099 2.6099 2.7413 2.7413 2.7995 2.7995 3.0404 3.0404 3.3727 3.3727 3.5895 3.5895 3.6478 3.6478 3.6693 3.6693 4.8430 4.8430 5.9171 5.9171 6.5016 6.5016 8.7564 8.7564 9.0110 9.0110 9.2730 9.2730 9.4982 9.4982 k = 0.1222-0.0594 0.0012 ( 7835 PWs) bands (ev): -17.4370 -17.4370 -15.5804 -15.5804 -12.2795 -12.2795 -11.4636 -11.4636 -11.2817 -11.2817 -9.4552 -9.4552 -9.3069 -9.3069 -6.3261 -6.3261 -5.5937 -5.5937 -5.2004 -5.2004 -3.6312 -3.6312 -3.0926 -3.0926 -2.5028 -2.5028 -2.0042 -2.0042 -1.2996 -1.2996 -1.0883 -1.0883 -0.1981 -0.1981 0.0794 0.0794 0.1300 0.1300 0.2006 0.2006 0.3425 0.3425 0.5158 0.5158 0.6354 0.6354 2.0674 2.0674 2.4764 2.4764 2.6123 2.6123 2.7419 2.7419 2.8024 2.8024 3.0604 3.0604 3.3755 3.3755 3.5982 3.5982 3.6599 3.6599 3.6829 3.6829 4.8498 4.8498 5.9131 5.9131 6.4451 6.4451 8.6887 8.6887 8.9984 8.9984 9.2799 9.2799 9.4894 9.4894 k = 0.1111-0.0540 0.0011 ( 7845 PWs) bands (ev): -17.4388 -17.4388 -15.5815 -15.5815 -12.2787 -12.2787 -11.4703 -11.4703 -11.2841 -11.2841 -9.4565 -9.4565 -9.3076 -9.3076 -6.3264 -6.3264 -5.5932 -5.5932 -5.1982 -5.1982 -3.6290 -3.6290 -3.0706 -3.0706 -2.5071 -2.5071 -2.0034 -2.0034 -1.3142 -1.3142 -1.0741 -1.0741 -0.1867 -0.1867 0.0958 0.0958 0.1388 0.1388 0.2100 0.2100 0.3385 0.3385 0.5098 0.5098 0.6323 0.6323 2.0671 2.0671 2.4858 2.4858 2.6140 2.6140 2.7426 2.7426 2.8049 2.8049 3.0813 3.0813 3.3774 3.3774 3.6054 3.6054 3.6711 3.6711 3.6978 3.6978 4.8563 4.8563 5.9090 5.9090 6.3909 6.3909 8.6214 8.6214 8.9848 8.9848 9.2878 9.2878 9.4786 9.4786 k = 0.1000-0.0486 0.0010 ( 7846 PWs) bands (ev): -17.4403 -17.4403 -15.5825 -15.5825 -12.2779 -12.2779 -11.4765 -11.4765 -11.2862 -11.2862 -9.4578 -9.4578 -9.3083 -9.3083 -6.3267 -6.3267 -5.5928 -5.5928 -5.1961 -5.1961 -3.6268 -3.6268 -3.0501 -3.0501 -2.5110 -2.5110 -2.0028 -2.0028 -1.3281 -1.3281 -1.0609 -1.0609 -0.1772 -0.1772 0.1090 0.1090 0.1479 0.1479 0.2200 0.2200 0.3354 0.3354 0.5043 0.5043 0.6299 0.6299 2.0670 2.0670 2.4946 2.4946 2.6149 2.6149 2.7433 2.7433 2.8071 2.8071 3.1028 3.1028 3.3783 3.3783 3.6112 3.6112 3.6812 3.6812 3.7139 3.7139 4.8623 4.8623 5.9050 5.9050 6.3394 6.3394 8.5564 8.5564 8.9704 8.9704 9.2963 9.2963 9.4671 9.4671 k = 0.0889-0.0432 0.0009 ( 7848 PWs) bands (ev): -17.4418 -17.4418 -15.5835 -15.5835 -12.2772 -12.2772 -11.4822 -11.4822 -11.2881 -11.2881 -9.4589 -9.4589 -9.3089 -9.3089 -6.3269 -6.3269 -5.5923 -5.5923 -5.1941 -5.1941 -3.6248 -3.6248 -3.0314 -3.0314 -2.5148 -2.5148 -2.0022 -2.0022 -1.3413 -1.3413 -1.0488 -1.0488 -0.1694 -0.1694 0.1191 0.1191 0.1569 0.1569 0.2305 0.2305 0.3330 0.3330 0.4993 0.4993 0.6280 0.6280 2.0669 2.0669 2.5028 2.5028 2.6153 2.6153 2.7440 2.7440 2.8090 2.8090 3.1245 3.1245 3.3783 3.3783 3.6157 3.6157 3.6901 3.6901 3.7305 3.7305 4.8679 4.8679 5.9012 5.9012 6.2912 6.2912 8.4951 8.4951 8.9554 8.9554 9.3048 9.3048 9.4555 9.4555 k = 0.0778-0.0378 0.0008 ( 7852 PWs) bands (ev): -17.4431 -17.4431 -15.5843 -15.5843 -12.2765 -12.2765 -11.4873 -11.4873 -11.2898 -11.2898 -9.4599 -9.4599 -9.3094 -9.3094 -6.3271 -6.3271 -5.5919 -5.5919 -5.1923 -5.1923 -3.6229 -3.6229 -3.0144 -3.0144 -2.5181 -2.5181 -2.0017 -2.0017 -1.3534 -1.3534 -1.0378 -1.0378 -0.1630 -0.1630 0.1267 0.1267 0.1650 0.1650 0.2415 0.2415 0.3312 0.3312 0.4948 0.4948 0.6266 0.6266 2.0670 2.0670 2.5102 2.5102 2.6152 2.6152 2.7447 2.7447 2.8106 2.8106 3.1460 3.1460 3.3773 3.3773 3.6192 3.6192 3.6979 3.6979 3.7470 3.7470 4.8730 4.8730 5.8976 5.8976 6.2469 6.2469 8.4384 8.4384 8.9403 8.9403 9.3130 9.3130 9.4445 9.4445 k = 0.0667-0.0324 0.0007 ( 7848 PWs) bands (ev): -17.4442 -17.4442 -15.5850 -15.5850 -12.2760 -12.2760 -11.4919 -11.4919 -11.2913 -11.2913 -9.4609 -9.4609 -9.3099 -9.3099 -6.3272 -6.3272 -5.5916 -5.5916 -5.1907 -5.1907 -3.6212 -3.6212 -2.9995 -2.9995 -2.5211 -2.5211 -2.0012 -2.0012 -1.3643 -1.3643 -1.0281 -1.0281 -0.1578 -0.1578 0.1325 0.1325 0.1715 0.1715 0.2527 0.2527 0.3298 0.3298 0.4909 0.4909 0.6257 0.6257 2.0670 2.0670 2.5170 2.5170 2.6147 2.6147 2.7455 2.7455 2.8119 2.8119 3.1669 3.1669 3.3752 3.3752 3.6218 3.6218 3.7047 3.7047 3.7628 3.7628 4.8775 4.8775 5.8944 5.8944 6.2070 6.2070 8.3875 8.3875 8.9258 8.9258 9.3205 9.3205 9.4344 9.4344 k = 0.0556-0.0270 0.0006 ( 7848 PWs) bands (ev): -17.4451 -17.4451 -15.5856 -15.5856 -12.2754 -12.2754 -11.4958 -11.4958 -11.2926 -11.2926 -9.4617 -9.4617 -9.3103 -9.3103 -6.3273 -6.3273 -5.5913 -5.5913 -5.1893 -5.1893 -3.6197 -3.6197 -2.9866 -2.9866 -2.5238 -2.5238 -2.0008 -2.0008 -1.3738 -1.3738 -1.0198 -1.0198 -0.1538 -0.1538 0.1369 0.1369 0.1765 0.1765 0.2636 0.2636 0.3285 0.3285 0.4875 0.4875 0.6252 0.6252 2.0672 2.0672 2.5229 2.5229 2.6140 2.6140 2.7462 2.7462 2.8129 2.8129 3.1868 3.1868 3.3722 3.3722 3.6237 3.6237 3.7105 3.7105 3.7773 3.7773 4.8814 4.8814 5.8916 5.8916 6.1720 6.1720 8.3431 8.3431 8.9124 8.9124 9.3267 9.3267 9.4260 9.4260 k = 0.0444-0.0216 0.0004 ( 7848 PWs) bands (ev): -17.4459 -17.4459 -15.5861 -15.5861 -12.2750 -12.2750 -11.4990 -11.4990 -11.2936 -11.2936 -9.4623 -9.4623 -9.3106 -9.3106 -6.3274 -6.3274 -5.5910 -5.5910 -5.1881 -5.1881 -3.6184 -3.6184 -2.9759 -2.9759 -2.5259 -2.5259 -2.0004 -2.0004 -1.3817 -1.3817 -1.0129 -1.0129 -0.1507 -0.1507 0.1404 0.1404 0.1800 0.1800 0.2737 0.2737 0.3272 0.3272 0.4848 0.4848 0.6250 0.6250 2.0673 2.0673 2.5280 2.5280 2.6131 2.6131 2.7468 2.7468 2.8137 2.8137 3.2050 3.2050 3.3684 3.3684 3.6250 3.6250 3.7152 3.7152 3.7900 3.7900 4.8846 4.8846 5.8892 5.8892 6.1424 6.1424 8.3058 8.3058 8.9005 8.9005 9.3313 9.3313 9.4200 9.4200 k = 0.0333-0.0162 0.0003 ( 7852 PWs) bands (ev): -17.4465 -17.4465 -15.5865 -15.5865 -12.2746 -12.2746 -11.5015 -11.5015 -11.2944 -11.2944 -9.4628 -9.4628 -9.3109 -9.3109 -6.3274 -6.3274 -5.5908 -5.5908 -5.1872 -5.1872 -3.6174 -3.6174 -2.9675 -2.9675 -2.5277 -2.5277 -2.0001 -2.0001 -1.3881 -1.3881 -1.0075 -1.0075 -0.1484 -0.1484 0.1429 0.1429 0.1823 0.1823 0.2824 0.2824 0.3258 0.3258 0.4826 0.4826 0.6250 0.6250 2.0674 2.0674 2.5320 2.5320 2.6122 2.6122 2.7473 2.7473 2.8142 2.8142 3.2208 3.2208 3.3642 3.3642 3.6259 3.6259 3.7189 3.7189 3.8004 3.8004 4.8872 4.8872 5.8873 5.8873 6.1189 6.1189 8.2762 8.2762 8.8908 8.8908 9.3341 9.3341 9.4169 9.4169 k = 0.0222-0.0108 0.0002 ( 7852 PWs) bands (ev): -17.4470 -17.4470 -15.5868 -15.5868 -12.2744 -12.2744 -11.5034 -11.5034 -11.2949 -11.2949 -9.4632 -9.4632 -9.3111 -9.3111 -6.3275 -6.3275 -5.5907 -5.5907 -5.1865 -5.1865 -3.6167 -3.6167 -2.9614 -2.9614 -2.5289 -2.5289 -1.9999 -1.9999 -1.3927 -1.3927 -1.0036 -1.0036 -0.1468 -0.1468 0.1447 0.1447 0.1838 0.1838 0.2894 0.2894 0.3244 0.3244 0.4811 0.4811 0.6251 0.6251 2.0675 2.0675 2.5351 2.5351 2.6114 2.6114 2.7477 2.7477 2.8146 2.8146 3.2334 3.2334 3.3601 3.3601 3.6264 3.6264 3.7215 3.7215 3.8081 3.8081 4.8891 4.8891 5.8860 5.8860 6.1017 6.1017 8.2548 8.2548 8.8835 8.8835 9.3352 9.3352 9.4165 9.4165 k = 0.0111-0.0054 0.0001 ( 7846 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5045 -11.5045 -11.2953 -11.2953 -9.4634 -9.4634 -9.3112 -9.3112 -6.3275 -6.3275 -5.5906 -5.5906 -5.1861 -5.1861 -3.6162 -3.6162 -2.9577 -2.9577 -2.5297 -2.5297 -1.9998 -1.9998 -1.3954 -1.3954 -1.0012 -1.0012 -0.1459 -0.1459 0.1458 0.1458 0.1846 0.1846 0.2941 0.2941 0.3232 0.3232 0.4801 0.4801 0.6251 0.6251 2.0675 2.0675 2.5369 2.5369 2.6109 2.6109 2.7480 2.7480 2.8149 2.8149 3.2416 3.2416 3.3571 3.3571 3.6267 3.6267 3.7231 3.7231 3.8129 3.8129 4.8902 4.8902 5.8852 5.8852 6.0913 6.0913 8.2418 8.2418 8.8791 8.8791 9.3355 9.3355 9.4178 9.4178 k = 0.0000 0.0000 0.0000 ( 7841 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5048 -11.5048 -11.2954 -11.2954 -9.4635 -9.4635 -9.3113 -9.3113 -6.3275 -6.3275 -5.5906 -5.5906 -5.1860 -5.1860 -3.6161 -3.6161 -2.9565 -2.9565 -2.5299 -2.5299 -1.9997 -1.9997 -1.3964 -1.3964 -1.0004 -1.0004 -0.1455 -0.1455 0.1462 0.1462 0.1849 0.1849 0.2958 0.2958 0.3227 0.3227 0.4798 0.4798 0.6252 0.6252 2.0676 2.0676 2.5375 2.5375 2.6108 2.6108 2.7480 2.7480 2.8149 2.8149 3.2445 3.2445 3.3560 3.3560 3.6268 3.6268 3.7237 3.7237 3.8145 3.8145 4.8906 4.8906 5.8849 5.8849 6.0878 6.0878 8.2375 8.2375 8.8775 8.8775 9.3355 9.3355 9.4187 9.4187 k = 0.0000 0.0000 0.0000 ( 7841 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5048 -11.5048 -11.2954 -11.2954 -9.4635 -9.4635 -9.3113 -9.3113 -6.3275 -6.3275 -5.5906 -5.5906 -5.1860 -5.1860 -3.6161 -3.6161 -2.9565 -2.9565 -2.5299 -2.5299 -1.9997 -1.9997 -1.3964 -1.3964 -1.0004 -1.0004 -0.1455 -0.1455 0.1462 0.1462 0.1849 0.1849 0.2958 0.2958 0.3227 0.3227 0.4798 0.4798 0.6252 0.6252 2.0676 2.0676 2.5375 2.5375 2.6108 2.6108 2.7480 2.7480 2.8149 2.8149 3.2445 3.2445 3.3560 3.3560 3.6268 3.6268 3.7237 3.7237 3.8145 3.8145 4.8906 4.8906 5.8849 5.8849 6.0878 6.0878 8.2375 8.2375 8.8775 8.8775 9.3355 9.3355 9.4187 9.4187 k =-0.0116-0.0009 0.0039 ( 7842 PWs) bands (ev): -17.4472 -17.4472 -15.5870 -15.5870 -12.2742 -12.2742 -11.5045 -11.5045 -11.2952 -11.2952 -9.4635 -9.4635 -9.3112 -9.3112 -6.3275 -6.3275 -5.5906 -5.5906 -5.1859 -5.1859 -3.6161 -3.6161 -2.9578 -2.9578 -2.5298 -2.5298 -1.9998 -1.9998 -1.3956 -1.3956 -1.0013 -1.0013 -0.1460 -0.1460 0.1459 0.1459 0.1844 0.1844 0.2932 0.2932 0.3237 0.3237 0.4807 0.4807 0.6252 0.6252 2.0676 2.0676 2.5368 2.5368 2.6109 2.6109 2.7479 2.7479 2.8148 2.8148 3.2413 3.2413 3.3573 3.3573 3.6268 3.6268 3.7231 3.7231 3.8128 3.8128 4.8903 4.8903 5.8853 5.8853 6.0914 6.0914 8.2425 8.2425 8.8786 8.8786 9.3346 9.3346 9.4173 9.4173 k =-0.0233-0.0018 0.0079 ( 7847 PWs) bands (ev): -17.4470 -17.4470 -15.5868 -15.5868 -12.2742 -12.2742 -11.5036 -11.5036 -11.2947 -11.2947 -9.4633 -9.4633 -9.3112 -9.3112 -6.3275 -6.3275 -5.5907 -5.5907 -5.1859 -5.1859 -3.6161 -3.6161 -2.9618 -2.9618 -2.5295 -2.5295 -2.0000 -2.0000 -1.3934 -1.3934 -1.0037 -1.0037 -0.1472 -0.1472 0.1450 0.1450 0.1829 0.1829 0.2866 0.2866 0.3260 0.3260 0.4832 0.4832 0.6252 0.6252 2.0675 2.0675 2.5347 2.5347 2.6115 2.6115 2.7476 2.7476 2.8143 2.8143 3.2321 3.2321 3.3608 3.3608 3.6266 3.6266 3.7215 3.7215 3.8078 3.8078 4.8897 4.8897 5.8864 5.8864 6.1020 6.1020 8.2575 8.2575 8.8817 8.8817 9.3316 9.3316 9.4166 9.4166 k =-0.0349-0.0028 0.0118 ( 7847 PWs) bands (ev): -17.4465 -17.4465 -15.5864 -15.5864 -12.2742 -12.2742 -11.5020 -11.5020 -11.2938 -11.2938 -9.4631 -9.4631 -9.3112 -9.3112 -6.3274 -6.3274 -5.5908 -5.5908 -5.1859 -5.1859 -3.6162 -3.6162 -2.9684 -2.9684 -2.5290 -2.5290 -2.0003 -2.0003 -1.3897 -1.3897 -1.0078 -1.0078 -0.1493 -0.1493 0.1434 0.1434 0.1801 0.1801 0.2774 0.2774 0.3280 0.3280 0.4873 0.4873 0.6253 0.6253 2.0674 2.0674 2.5312 2.5312 2.6122 2.6122 2.7472 2.7472 2.8136 2.8136 3.2181 3.2181 3.3655 3.3655 3.6262 3.6262 3.7189 3.7189 3.7997 3.7997 4.8886 4.8886 5.8882 5.8882 6.1195 6.1195 8.2823 8.2823 8.8867 8.8867 9.3258 9.3258 9.4204 9.4204 k =-0.0465-0.0037 0.0157 ( 7850 PWs) bands (ev): -17.4458 -17.4458 -15.5860 -15.5860 -12.2743 -12.2743 -11.4998 -11.4998 -11.2927 -11.2927 -9.4628 -9.4628 -9.3111 -9.3111 -6.3274 -6.3274 -5.5909 -5.5909 -5.1858 -5.1858 -3.6163 -3.6163 -2.9775 -2.9775 -2.5283 -2.5283 -2.0008 -2.0008 -1.3846 -1.3846 -1.0135 -1.0135 -0.1524 -0.1524 0.1410 0.1410 0.1760 0.1760 0.2669 0.2669 0.3294 0.3294 0.4929 0.4929 0.6256 0.6256 2.0673 2.0673 2.5266 2.5266 2.6131 2.6131 2.7466 2.7466 2.8125 2.8125 3.2007 3.2007 3.3703 3.3703 3.6255 3.6255 3.7151 3.7151 3.7887 3.7887 4.8871 4.8871 5.8907 5.8907 6.1435 6.1435 8.3163 8.3163 8.8936 8.8936 9.3172 9.3172 9.4295 9.4295 k =-0.0581-0.0046 0.0196 ( 7852 PWs) bands (ev): -17.4450 -17.4450 -15.5854 -15.5854 -12.2743 -12.2743 -11.4970 -11.4970 -11.2911 -11.2911 -9.4623 -9.4623 -9.3111 -9.3111 -6.3273 -6.3273 -5.5911 -5.5911 -5.1857 -5.1857 -3.6164 -3.6164 -2.9890 -2.9890 -2.5275 -2.5275 -2.0014 -2.0014 -1.3780 -1.3780 -1.0207 -1.0207 -0.1564 -0.1564 0.1375 0.1375 0.1702 0.1702 0.2555 0.2555 0.3300 0.3300 0.4998 0.4998 0.6262 0.6262 2.0673 2.0673 2.5209 2.5209 2.6139 2.6139 2.7459 2.7459 2.8110 2.8110 3.1807 3.1807 3.3748 3.3748 3.6245 3.6245 3.7103 3.7103 3.7753 3.7753 4.8852 4.8852 5.8939 5.8939 6.1735 6.1735 8.3589 8.3589 8.9024 8.9024 9.3065 9.3065 9.4429 9.4429 k =-0.0698-0.0055 0.0236 ( 7858 PWs) bands (ev): -17.4439 -17.4439 -15.5847 -15.5847 -12.2744 -12.2744 -11.4936 -11.4936 -11.2893 -11.2893 -9.4618 -9.4618 -9.3110 -9.3110 -6.3272 -6.3272 -5.5913 -5.5913 -5.1855 -5.1855 -3.6165 -3.6165 -3.0029 -3.0029 -2.5264 -2.5264 -2.0021 -2.0021 -1.3702 -1.3702 -1.0294 -1.0294 -0.1615 -0.1615 0.1326 0.1326 0.1627 0.1627 0.2440 0.2440 0.3302 0.3302 0.5079 0.5079 0.6272 0.6272 2.0672 2.0672 2.5142 2.5142 2.6144 2.6144 2.7451 2.7451 2.8090 2.8090 3.1590 3.1590 3.3785 3.3785 3.6228 3.6228 3.7044 3.7044 3.7600 3.7600 4.8831 4.8831 5.8976 5.8976 6.2091 6.2091 8.4091 8.4091 8.9130 8.9130 9.2943 9.2943 9.4591 9.4591 k =-0.0814-0.0064 0.0275 ( 7856 PWs) bands (ev): -17.4427 -17.4427 -15.5839 -15.5839 -12.2744 -12.2744 -11.4897 -11.4897 -11.2872 -11.2872 -9.4612 -9.4612 -9.3109 -9.3109 -6.3271 -6.3271 -5.5916 -5.5916 -5.1854 -5.1854 -3.6166 -3.6166 -3.0190 -3.0190 -2.5252 -2.5252 -2.0029 -2.0029 -1.3610 -1.3610 -1.0395 -1.0395 -0.1678 -0.1678 0.1252 0.1252 0.1538 0.1538 0.2326 0.2326 0.3302 0.3302 0.5169 0.5169 0.6287 0.6287 2.0672 2.0672 2.5066 2.5066 2.6146 2.6146 2.7443 2.7443 2.8066 2.8066 3.1362 3.1362 3.3812 3.3812 3.6204 3.6204 3.6975 3.6975 3.7434 3.7434 4.8807 4.8807 5.9018 5.9018 6.2496 6.2496 8.4658 8.4658 8.9256 8.9256 9.2811 9.2811 9.4761 9.4761 k =-0.0930-0.0074 0.0314 ( 7854 PWs) bands (ev): -17.4414 -17.4414 -15.5830 -15.5830 -12.2745 -12.2745 -11.4851 -11.4851 -11.2848 -11.2848 -9.4605 -9.4605 -9.3108 -9.3108 -6.3270 -6.3270 -5.5919 -5.5919 -5.1852 -5.1852 -3.6168 -3.6168 -3.0372 -3.0372 -2.5239 -2.5239 -2.0038 -2.0038 -1.3507 -1.3507 -1.0509 -1.0509 -0.1755 -0.1755 0.1142 0.1142 0.1444 0.1444 0.2217 0.2217 0.3306 0.3306 0.5266 0.5266 0.6307 0.6307 2.0673 2.0673 2.4983 2.4983 2.6142 2.6142 2.7435 2.7435 2.8037 2.8037 3.1129 3.1129 3.3830 3.3830 3.6170 3.6170 3.6895 3.6895 3.7262 3.7262 4.8782 4.8782 5.9065 5.9065 6.2944 6.2944 8.5272 8.5272 8.9408 8.9408 9.2671 9.2671 9.4929 9.4929 k =-0.1047-0.0083 0.0354 ( 7853 PWs) bands (ev): -17.4398 -17.4398 -15.5819 -15.5819 -12.2746 -12.2746 -11.4800 -11.4800 -11.2821 -11.2821 -9.4598 -9.4598 -9.3107 -9.3107 -6.3269 -6.3269 -5.5922 -5.5922 -5.1850 -5.1850 -3.6170 -3.6170 -3.0573 -3.0573 -2.5223 -2.5223 -2.0048 -2.0048 -1.3393 -1.3393 -1.0636 -1.0636 -0.1847 -0.1847 0.0989 0.0989 0.1353 0.1353 0.2113 0.2113 0.3317 0.3317 0.5370 0.5370 0.6333 0.6333 2.0675 2.0675 2.4894 2.4894 2.6133 2.6133 2.7427 2.7427 2.8002 2.8002 3.0896 3.0896 3.3836 3.3836 3.6122 3.6122 3.6804 3.6804 3.7090 3.7090 4.8756 4.8756 5.9115 5.9115 6.3430 6.3430 8.5912 8.5912 8.9593 8.9593 9.2523 9.2523 9.5084 9.5084 k =-0.1163-0.0092 0.0393 ( 7851 PWs) bands (ev): -17.4382 -17.4382 -15.5808 -15.5808 -12.2747 -12.2747 -11.4744 -11.4744 -11.2791 -11.2791 -9.4589 -9.4589 -9.3105 -9.3105 -6.3268 -6.3268 -5.5926 -5.5926 -5.1847 -5.1847 -3.6172 -3.6172 -3.0792 -3.0792 -2.5207 -2.5207 -2.0060 -2.0060 -1.3270 -1.3270 -1.0774 -1.0774 -0.1956 -0.1956 0.0797 0.0797 0.1261 0.1261 0.2016 0.2016 0.3338 0.3338 0.5478 0.5478 0.6366 0.6366 2.0678 2.0678 2.4797 2.4797 2.6116 2.6116 2.7419 2.7419 2.7962 2.7962 3.0667 3.0667 3.3833 3.3833 3.6056 3.6056 3.6704 3.6704 3.6925 3.6925 4.8729 4.8729 5.9167 5.9167 6.3947 6.3947 8.6547 8.6547 8.9827 8.9827 9.2365 9.2365 9.5223 9.5223 k =-0.1279-0.0101 0.0432 ( 7853 PWs) bands (ev): -17.4363 -17.4363 -15.5796 -15.5796 -12.2748 -12.2748 -11.4682 -11.4682 -11.2759 -11.2759 -9.4580 -9.4580 -9.3104 -9.3104 -6.3267 -6.3267 -5.5930 -5.5930 -5.1844 -5.1844 -3.6174 -3.6174 -3.1026 -3.1026 -2.5189 -2.5189 -2.0073 -2.0073 -1.3138 -1.3138 -1.0921 -1.0921 -0.2083 -0.2083 0.0574 0.0574 0.1162 0.1162 0.1928 0.1928 0.3370 0.3370 0.5588 0.5588 0.6405 0.6405 2.0683 2.0683 2.4695 2.4695 2.6091 2.6091 2.7411 2.7411 2.7915 2.7915 3.0447 3.0447 3.3818 3.3818 3.5968 3.5968 3.6597 3.6597 3.6773 3.6773 4.8703 4.8703 5.9220 5.9220 6.4492 6.4492 8.7140 8.7140 9.0125 9.0125 9.2196 9.2196 9.5345 9.5345 k =-0.1395-0.0110 0.0472 ( 7853 PWs) bands (ev): -17.4344 -17.4344 -15.5782 -15.5782 -12.2750 -12.2750 -11.4616 -11.4616 -11.2724 -11.2724 -9.4570 -9.4570 -9.3103 -9.3103 -6.3265 -6.3265 -5.5934 -5.5934 -5.1841 -5.1841 -3.6177 -3.6177 -3.1274 -3.1274 -2.5170 -2.5170 -2.0087 -2.0087 -1.3000 -1.3000 -1.1077 -1.1077 -0.2230 -0.2230 0.0327 0.0327 0.1053 0.1053 0.1849 0.1849 0.3415 0.3415 0.5699 0.5699 0.6449 0.6449 2.0690 2.0690 2.4589 2.4589 2.6058 2.6058 2.7404 2.7404 2.7862 2.7862 3.0239 3.0239 3.3793 3.3793 3.5856 3.5856 3.6488 3.6488 3.6635 3.6635 4.8678 4.8678 5.9274 5.9274 6.5057 6.5057 8.7655 8.7655 9.0499 9.0499 9.2015 9.2015 9.5452 9.5452 k =-0.1512-0.0120 0.0511 ( 7845 PWs) bands (ev): -17.4323 -17.4323 -15.5768 -15.5768 -12.2751 -12.2751 -11.4545 -11.4545 -11.2688 -11.2688 -9.4560 -9.4560 -9.3101 -9.3101 -6.3263 -6.3263 -5.5939 -5.5939 -5.1838 -5.1838 -3.6179 -3.6179 -3.1535 -3.1535 -2.5150 -2.5150 -2.0102 -2.0102 -1.2857 -1.2857 -1.1240 -1.1240 -0.2398 -0.2398 0.0062 0.0062 0.0934 0.0934 0.1779 0.1779 0.3472 0.3472 0.5810 0.5810 0.6499 0.6499 2.0700 2.0700 2.4478 2.4478 2.6016 2.6016 2.7397 2.7397 2.7804 2.7804 3.0046 3.0046 3.3758 3.3758 3.5723 3.5723 3.6377 3.6377 3.6509 3.6509 4.8655 4.8655 5.9327 5.9327 6.5639 6.5639 8.8072 8.8072 9.0933 9.0933 9.1823 9.1823 9.5548 9.5548 k =-0.1628-0.0129 0.0550 ( 7847 PWs) bands (ev): -17.4301 -17.4301 -15.5753 -15.5753 -12.2753 -12.2753 -11.4470 -11.4470 -11.2650 -11.2650 -9.4549 -9.4549 -9.3100 -9.3100 -6.3261 -6.3261 -5.5944 -5.5944 -5.1834 -5.1834 -3.6182 -3.6182 -3.1805 -3.1805 -2.5129 -2.5129 -2.0118 -2.0118 -1.2714 -1.2714 -1.1406 -1.1406 -0.2588 -0.2588 -0.0216 -0.0216 0.0807 0.0807 0.1719 0.1719 0.3540 0.3540 0.5920 0.5920 0.6554 0.6554 2.0712 2.0712 2.4363 2.4363 2.5965 2.5965 2.7390 2.7390 2.7741 2.7741 2.9870 2.9870 3.3711 3.3711 3.5575 3.5575 3.6261 3.6261 3.6397 3.6397 4.8634 4.8634 5.9378 5.9378 6.6234 6.6234 8.8395 8.8395 9.1327 9.1327 9.1672 9.1672 9.5640 9.5640 k =-0.1744-0.0138 0.0589 ( 7846 PWs) bands (ev): -17.4278 -17.4278 -15.5738 -15.5738 -12.2755 -12.2755 -11.4391 -11.4391 -11.2610 -11.2610 -9.4537 -9.4537 -9.3098 -9.3098 -6.3260 -6.3260 -5.5950 -5.5950 -5.1830 -5.1830 -3.6185 -3.6185 -3.2084 -3.2084 -2.5108 -2.5108 -2.0136 -2.0136 -1.2576 -1.2576 -1.1571 -1.1571 -0.2800 -0.2800 -0.0503 -0.0503 0.0677 0.0677 0.1667 0.1667 0.3619 0.3619 0.6027 0.6027 0.6612 0.6612 2.0727 2.0727 2.4246 2.4246 2.5905 2.5905 2.7381 2.7381 2.7674 2.7674 2.9712 2.9712 3.3652 3.3652 3.5418 3.5418 3.6135 3.6135 3.6300 3.6300 4.8617 4.8617 5.9426 5.9426 6.6838 6.6838 8.8646 8.8646 9.1272 9.1272 9.1904 9.1904 9.5744 9.5744 k =-0.1860-0.0147 0.0629 ( 7842 PWs) bands (ev): -17.4253 -17.4253 -15.5722 -15.5722 -12.2757 -12.2757 -11.4308 -11.4308 -11.2569 -11.2569 -9.4525 -9.4525 -9.3097 -9.3097 -6.3258 -6.3258 -5.5955 -5.5955 -5.1826 -5.1826 -3.6189 -3.6189 -3.2369 -3.2369 -2.5086 -2.5086 -2.0156 -2.0156 -1.2456 -1.2456 -1.1723 -1.1723 -0.3034 -0.3034 -0.0794 -0.0794 0.0547 0.0547 0.1621 0.1621 0.3707 0.3707 0.6131 0.6131 0.6674 0.6674 2.0745 2.0745 2.4126 2.4126 2.5837 2.5837 2.7371 2.7371 2.7605 2.7605 2.9573 2.9573 3.3583 3.3583 3.5257 3.5257 3.5998 3.5998 3.6213 3.6213 4.8603 4.8603 5.9471 5.9471 6.7447 6.7447 8.8847 8.8847 9.1012 9.1012 9.2204 9.2204 9.5875 9.5875 k =-0.1977-0.0157 0.0668 ( 7839 PWs) bands (ev): -17.4229 -17.4229 -15.5705 -15.5705 -12.2759 -12.2759 -11.4222 -11.4222 -11.2527 -11.2527 -9.4512 -9.4512 -9.3095 -9.3095 -6.3256 -6.3256 -5.5961 -5.5961 -5.1821 -5.1821 -3.6193 -3.6193 -3.2659 -3.2659 -2.5063 -2.5063 -2.0177 -2.0177 -1.2385 -1.2385 -1.1830 -1.1830 -0.3287 -0.3287 -0.1084 -0.1084 0.0418 0.0418 0.1580 0.1580 0.3804 0.3804 0.6231 0.6231 0.6737 0.6737 2.0766 2.0766 2.4005 2.4005 2.5762 2.5762 2.7357 2.7357 2.7538 2.7538 2.9452 2.9452 3.3501 3.3501 3.5097 3.5097 3.5855 3.5855 3.6131 3.6131 4.8593 4.8593 5.9512 5.9512 6.8057 6.8057 8.9015 8.9015 9.0704 9.0704 9.2374 9.2374 9.6040 9.6040 k =-0.2093-0.0166 0.0707 ( 7837 PWs) bands (ev): -17.4203 -17.4203 -15.5688 -15.5688 -12.2761 -12.2761 -11.4133 -11.4133 -11.2484 -11.2484 -9.4499 -9.4499 -9.3094 -9.3094 -6.3254 -6.3254 -5.5967 -5.5967 -5.1816 -5.1816 -3.6199 -3.6199 -3.2950 -3.2950 -2.5040 -2.5040 -2.0200 -2.0200 -1.2415 -1.2415 -1.1843 -1.1843 -0.3560 -0.3560 -0.1369 -0.1369 0.0294 0.0294 0.1542 0.1542 0.3907 0.3907 0.6326 0.6326 0.6801 0.6801 2.0791 2.0791 2.3884 2.3884 2.5682 2.5682 2.7331 2.7331 2.7480 2.7480 2.9348 2.9348 3.3408 3.3408 3.4938 3.4938 3.5709 3.5709 3.6051 3.6051 4.8588 4.8588 5.9548 5.9548 6.8667 6.8667 8.9157 8.9157 9.0360 9.0360 9.2403 9.2403 9.6229 9.6229 k =-0.2209-0.0175 0.0747 ( 7836 PWs) bands (ev): -17.4177 -17.4177 -15.5670 -15.5670 -12.2764 -12.2764 -11.4042 -11.4042 -11.2441 -11.2441 -9.4486 -9.4486 -9.3092 -9.3092 -6.3251 -6.3251 -5.5973 -5.5973 -5.1810 -5.1810 -3.6205 -3.6205 -3.3243 -3.3243 -2.5018 -2.5018 -2.0224 -2.0224 -1.2540 -1.2540 -1.1770 -1.1770 -0.3849 -0.3849 -0.1643 -0.1643 0.0175 0.0175 0.1507 0.1507 0.4017 0.4017 0.6417 0.6417 0.6866 0.6866 2.0819 2.0819 2.3763 2.3763 2.5597 2.5597 2.7287 2.7287 2.7440 2.7440 2.9260 2.9260 3.3303 3.3303 3.4779 3.4779 3.5561 3.5561 3.5972 3.5972 4.8587 4.8587 5.9578 5.9578 6.9274 6.9274 8.9271 8.9271 8.9990 8.9990 9.2320 9.2320 9.6421 9.6421 k =-0.2326-0.0184 0.0786 ( 7840 PWs) bands (ev): -17.4151 -17.4151 -15.5652 -15.5652 -12.2766 -12.2766 -11.3948 -11.3948 -11.2397 -11.2397 -9.4472 -9.4472 -9.3091 -9.3091 -6.3249 -6.3249 -5.5980 -5.5980 -5.1805 -5.1805 -3.6212 -3.6212 -3.3534 -3.3534 -2.4995 -2.4995 -2.0251 -2.0251 -1.2708 -1.2708 -1.1663 -1.1663 -0.4152 -0.4152 -0.1902 -0.1902 0.0061 0.0061 0.1474 0.1474 0.4131 0.4131 0.6502 0.6502 0.6930 0.6930 2.0851 2.0851 2.3644 2.3644 2.5509 2.5509 2.7223 2.7223 2.7420 2.7420 2.9187 2.9187 3.3186 3.3186 3.4619 3.4619 3.5416 3.5416 3.5892 3.5892 4.8591 4.8591 5.9602 5.9602 6.9875 6.9875 8.9300 8.9300 8.9659 8.9659 9.2163 9.2163 9.6598 9.6598 k =-0.2442-0.0193 0.0825 ( 7836 PWs) bands (ev): -17.4124 -17.4124 -15.5634 -15.5634 -12.2769 -12.2769 -11.3852 -11.3852 -11.2354 -11.2354 -9.4459 -9.4459 -9.3089 -9.3089 -6.3247 -6.3247 -5.5986 -5.5986 -5.1799 -5.1799 -3.6222 -3.6222 -3.3821 -3.3821 -2.4972 -2.4972 -2.0280 -2.0280 -1.2892 -1.2892 -1.1552 -1.1552 -0.4465 -0.4465 -0.2139 -0.2139 -0.0047 -0.0047 0.1443 0.1443 0.4249 0.4249 0.6581 0.6581 0.6995 0.6995 2.0887 2.0887 2.3527 2.3527 2.5420 2.5420 2.7149 2.7149 2.7412 2.7412 2.9126 2.9126 3.3058 3.3058 3.4456 3.4456 3.5276 3.5276 3.5812 3.5812 4.8600 4.8600 5.9619 5.9619 7.0468 7.0468 8.9014 8.9014 8.9602 8.9602 9.1965 9.1965 9.6746 9.6746 k =-0.2558-0.0203 0.0865 ( 7836 PWs) bands (ev): -17.4097 -17.4097 -15.5616 -15.5616 -12.2772 -12.2772 -11.3755 -11.3755 -11.2311 -11.2311 -9.4445 -9.4445 -9.3088 -9.3088 -6.3245 -6.3245 -5.5993 -5.5993 -5.1793 -5.1793 -3.6234 -3.6234 -3.4102 -3.4102 -2.4950 -2.4950 -2.0311 -2.0311 -1.3083 -1.3083 -1.1448 -1.1448 -0.4787 -0.4787 -0.2352 -0.2352 -0.0150 -0.0150 0.1413 0.1413 0.4369 0.4369 0.6652 0.6652 0.7060 0.7060 2.0926 2.0926 2.3412 2.3412 2.5333 2.5333 2.7070 2.7070 2.7411 2.7411 2.9075 2.9075 3.2919 3.2919 3.4286 3.4286 3.5144 3.5144 3.5733 3.5733 4.8614 4.8614 5.9631 5.9631 7.1052 7.1052 8.8570 8.8570 8.9663 8.9663 9.1753 9.1753 9.6847 9.6847 k =-0.2674-0.0212 0.0904 ( 7835 PWs) bands (ev): -17.4071 -17.4071 -15.5599 -15.5599 -12.2775 -12.2775 -11.3657 -11.3657 -11.2269 -11.2269 -9.4431 -9.4431 -9.3087 -9.3087 -6.3242 -6.3242 -5.5999 -5.5999 -5.1786 -5.1786 -3.6250 -3.6250 -3.4375 -3.4375 -2.4928 -2.4928 -2.0344 -2.0344 -1.3277 -1.3277 -1.1356 -1.1356 -0.5113 -0.5113 -0.2536 -0.2536 -0.0248 -0.0248 0.1384 0.1384 0.4491 0.4491 0.6713 0.6713 0.7127 0.7127 2.0969 2.0969 2.3302 2.3302 2.5248 2.5248 2.6990 2.6990 2.7414 2.7414 2.9034 2.9034 3.2770 3.2770 3.4108 3.4108 3.5021 3.5021 3.5654 3.5654 4.8632 4.8632 5.9636 5.9636 7.1624 7.1624 8.8095 8.8095 8.9720 8.9720 9.1545 9.1545 9.6862 9.6862 k =-0.2791-0.0221 0.0943 ( 7828 PWs) bands (ev): -17.4044 -17.4044 -15.5581 -15.5581 -12.2778 -12.2778 -11.3558 -11.3558 -11.2229 -11.2229 -9.4418 -9.4418 -9.3086 -9.3086 -6.3240 -6.3240 -5.6006 -5.6006 -5.1779 -5.1779 -3.6271 -3.6271 -3.4637 -3.4637 -2.4907 -2.4907 -2.0380 -2.0380 -1.3469 -1.3469 -1.1281 -1.1281 -0.5441 -0.5441 -0.2688 -0.2688 -0.0341 -0.0341 0.1355 0.1355 0.4613 0.4613 0.6764 0.6764 0.7195 0.7195 2.1015 2.1015 2.3196 2.3196 2.5168 2.5168 2.6909 2.6909 2.7422 2.7422 2.9001 2.9001 3.2610 3.2610 3.3921 3.3921 3.4910 3.4910 3.5576 3.5576 4.8655 4.8655 5.9635 5.9635 7.2184 7.2184 8.7609 8.7609 8.9747 8.9747 9.1361 9.1361 9.6753 9.6753 k =-0.2907-0.0230 0.0982 ( 7831 PWs) bands (ev): -17.4018 -17.4018 -15.5563 -15.5563 -12.2782 -12.2782 -11.3459 -11.3459 -11.2190 -11.2190 -9.4404 -9.4404 -9.3085 -9.3085 -6.3238 -6.3238 -5.6013 -5.6013 -5.1773 -5.1773 -3.6300 -3.6300 -3.4883 -3.4883 -2.4886 -2.4886 -2.0417 -2.0417 -1.3660 -1.3660 -1.1226 -1.1226 -0.5766 -0.5766 -0.2807 -0.2807 -0.0428 -0.0428 0.1327 0.1327 0.4735 0.4735 0.6803 0.6803 0.7267 0.7267 2.1064 2.1064 2.3096 2.3096 2.5092 2.5092 2.6827 2.6827 2.7434 2.7434 2.8974 2.8974 3.2441 3.2441 3.3724 3.3724 3.4810 3.4810 3.5500 3.5500 4.8681 4.8681 5.9628 5.9628 7.2730 7.2730 8.7122 8.7122 8.9727 8.9727 9.1218 9.1218 9.6548 9.6548 k =-0.3023-0.0239 0.1022 ( 7831 PWs) bands (ev): -17.3992 -17.3992 -15.5546 -15.5546 -12.2785 -12.2785 -11.3360 -11.3360 -11.2152 -11.2152 -9.4391 -9.4391 -9.3084 -9.3084 -6.3236 -6.3236 -5.6020 -5.6020 -5.1766 -5.1766 -3.6341 -3.6341 -3.5110 -3.5110 -2.4867 -2.4867 -2.0456 -2.0456 -1.3847 -1.3847 -1.1192 -1.1192 -0.6086 -0.6086 -0.2890 -0.2890 -0.0511 -0.0511 0.1298 0.1298 0.4854 0.4854 0.6829 0.6829 0.7341 0.7341 2.1116 2.1116 2.3001 2.3001 2.5024 2.5024 2.6747 2.6747 2.7449 2.7449 2.8952 2.8952 3.2263 3.2263 3.3517 3.3517 3.4720 3.4720 3.5427 3.5427 4.8711 4.8711 5.9616 5.9616 7.3261 7.3261 8.6640 8.6640 8.9650 8.9650 9.1128 9.1128 9.6299 9.6299 k =-0.3140-0.0249 0.1061 ( 7830 PWs) bands (ev): -17.3967 -17.3967 -15.5529 -15.5529 -12.2788 -12.2788 -11.3262 -11.3262 -11.2117 -11.2117 -9.4378 -9.4378 -9.3083 -9.3083 -6.3233 -6.3233 -5.6026 -5.6026 -5.1759 -5.1759 -3.6398 -3.6398 -3.5311 -3.5311 -2.4848 -2.4848 -2.0497 -2.0497 -1.4029 -1.4029 -1.1178 -1.1178 -0.6398 -0.6398 -0.2939 -0.2939 -0.0587 -0.0587 0.1270 0.1270 0.4971 0.4971 0.6844 0.6844 0.7418 0.7418 2.1170 2.1170 2.2912 2.2912 2.4963 2.4963 2.6667 2.6667 2.7469 2.7469 2.8936 2.8936 3.2077 3.2077 3.3303 3.3303 3.4641 3.4641 3.5357 3.5357 4.8743 4.8743 5.9598 5.9598 7.3776 7.3776 8.6168 8.6168 8.9517 8.9517 9.1092 9.1092 9.6031 9.6031 k =-0.3256-0.0258 0.1100 ( 7828 PWs) bands (ev): -17.3942 -17.3942 -15.5512 -15.5512 -12.2792 -12.2792 -11.3165 -11.3165 -11.2085 -11.2085 -9.4365 -9.4365 -9.3082 -9.3082 -6.3231 -6.3231 -5.6033 -5.6033 -5.1752 -5.1752 -3.6475 -3.6475 -3.5480 -3.5480 -2.4830 -2.4830 -2.0539 -2.0539 -1.4206 -1.4206 -1.1186 -1.1186 -0.6699 -0.6699 -0.2956 -0.2956 -0.0658 -0.0658 0.1241 0.1241 0.5084 0.5084 0.6847 0.6847 0.7497 0.7497 2.1225 2.1225 2.2830 2.2830 2.4911 2.4911 2.6589 2.6589 2.7493 2.7493 2.8924 2.8924 3.1884 3.1884 3.3083 3.3083 3.4571 3.4571 3.5290 3.5290 4.8778 4.8778 5.9577 5.9577 7.4275 7.4275 8.5709 8.5709 8.9341 8.9341 9.1098 9.1098 9.5757 9.5757 k =-0.3372-0.0267 0.1140 ( 7830 PWs) bands (ev): -17.3919 -17.3919 -15.5497 -15.5497 -12.2795 -12.2795 -11.3070 -11.3070 -11.2055 -11.2055 -9.4353 -9.4353 -9.3082 -9.3082 -6.3229 -6.3229 -5.6039 -5.6039 -5.1745 -5.1745 -3.6577 -3.6577 -3.5614 -3.5614 -2.4814 -2.4814 -2.0582 -2.0582 -1.4375 -1.4375 -1.1212 -1.1212 -0.6987 -0.6987 -0.2942 -0.2942 -0.0721 -0.0721 0.1211 0.1211 0.5192 0.5192 0.6839 0.6839 0.7577 0.7577 2.1282 2.1282 2.2754 2.2754 2.4869 2.4869 2.6512 2.6512 2.7521 2.7521 2.8916 2.8916 3.1684 3.1684 3.2858 3.2858 3.4509 3.4509 3.5226 3.5226 4.8814 4.8814 5.9551 5.9551 7.4758 7.4758 8.5266 8.5266 8.9137 8.9137 9.1132 9.1132 9.5480 9.5480 k =-0.3488-0.0276 0.1179 ( 7833 PWs) bands (ev): -17.3896 -17.3896 -15.5481 -15.5481 -12.2798 -12.2798 -11.2976 -11.2976 -11.2028 -11.2028 -9.4341 -9.4341 -9.3081 -9.3081 -6.3227 -6.3227 -5.6045 -5.6045 -5.1738 -5.1738 -3.6702 -3.6702 -3.5713 -3.5713 -2.4798 -2.4798 -2.0626 -2.0626 -1.4538 -1.4538 -1.1255 -1.1255 -0.7260 -0.7260 -0.2903 -0.2903 -0.0777 -0.0777 0.1181 0.1181 0.5296 0.5296 0.6821 0.6821 0.7657 0.7657 2.1339 2.1339 2.2685 2.2685 2.4836 2.4836 2.6437 2.6437 2.7553 2.7553 2.8911 2.8911 3.1480 3.1480 3.2631 3.2631 3.4454 3.4454 3.5166 3.5166 4.8851 4.8851 5.9523 5.9523 7.5223 7.5223 8.4840 8.4840 8.8920 8.8920 9.1183 9.1183 9.5202 9.5202 k =-0.3605-0.0285 0.1218 ( 7836 PWs) bands (ev): -17.3875 -17.3875 -15.5467 -15.5467 -12.2801 -12.2801 -11.2885 -11.2885 -11.2005 -11.2005 -9.4330 -9.4330 -9.3081 -9.3081 -6.3225 -6.3225 -5.6051 -5.6051 -5.1732 -5.1732 -3.6842 -3.6842 -3.5783 -3.5783 -2.4784 -2.4784 -2.0669 -2.0669 -1.4692 -1.4692 -1.1312 -1.1312 -0.7516 -0.7516 -0.2842 -0.2842 -0.0823 -0.0823 0.1149 0.1149 0.5393 0.5393 0.6795 0.6795 0.7736 0.7736 2.1395 2.1395 2.2623 2.2623 2.4815 2.4815 2.6363 2.6363 2.7588 2.7588 2.8911 2.8911 3.1273 3.1273 3.2403 3.2403 3.4405 3.4405 3.5111 3.5111 4.8889 4.8889 5.9492 5.9492 7.5671 7.5671 8.4432 8.4432 8.8698 8.8698 9.1243 9.1243 9.4926 9.4926 k =-0.3721-0.0295 0.1258 ( 7831 PWs) bands (ev): -17.3855 -17.3855 -15.5454 -15.5454 -12.2804 -12.2804 -11.2796 -11.2796 -11.1986 -11.1986 -9.4319 -9.4319 -9.3080 -9.3080 -6.3223 -6.3223 -5.6056 -5.6056 -5.1726 -5.1726 -3.6989 -3.6989 -3.5831 -3.5831 -2.4771 -2.4771 -2.0713 -2.0713 -1.4837 -1.4837 -1.1380 -1.1380 -0.7753 -0.7753 -0.2766 -0.2766 -0.0858 -0.0858 0.1115 0.1115 0.5485 0.5485 0.6761 0.6761 0.7814 0.7814 2.1450 2.1450 2.2568 2.2568 2.4805 2.4805 2.6291 2.6291 2.7627 2.7627 2.8916 2.8916 3.1065 3.1065 3.2177 3.2177 3.4362 3.4362 3.5060 3.5060 4.8926 4.8926 5.9461 5.9461 7.6101 7.6101 8.4041 8.4041 8.8480 8.8480 9.1308 9.1308 9.4652 9.4652 k =-0.3837-0.0304 0.1297 ( 7827 PWs) bands (ev): -17.3836 -17.3836 -15.5441 -15.5441 -12.2807 -12.2807 -11.2710 -11.2710 -11.1971 -11.1971 -9.4309 -9.4309 -9.3080 -9.3080 -6.3222 -6.3222 -5.6062 -5.6062 -5.1719 -5.1719 -3.7136 -3.7136 -3.5865 -3.5865 -2.4759 -2.4759 -2.0755 -2.0755 -1.4972 -1.4972 -1.1454 -1.1454 -0.7972 -0.7972 -0.2681 -0.2681 -0.0881 -0.0881 0.1080 0.1080 0.5571 0.5571 0.6720 0.6720 0.7888 0.7888 2.1502 2.1502 2.2519 2.2519 2.4806 2.4806 2.6220 2.6220 2.7670 2.7670 2.8925 2.8925 3.0856 3.0856 3.1954 3.1954 3.4325 3.4325 3.5013 3.5013 4.8963 4.8963 5.9428 5.9428 7.6514 7.6514 8.3668 8.3668 8.8270 8.8270 9.1376 9.1376 9.4383 9.4383 k =-0.3953-0.0313 0.1336 ( 7824 PWs) bands (ev): -17.3818 -17.3818 -15.5429 -15.5429 -12.2810 -12.2810 -11.2628 -11.2628 -11.1960 -11.1960 -9.4300 -9.4300 -9.3080 -9.3080 -6.3220 -6.3220 -5.6066 -5.6066 -5.1714 -5.1714 -3.7277 -3.7277 -3.5889 -3.5889 -2.4749 -2.4749 -2.0796 -2.0796 -1.5096 -1.5096 -1.1533 -1.1533 -0.8170 -0.8170 -0.2593 -0.2593 -0.0890 -0.0890 0.1043 0.1043 0.5650 0.5650 0.6674 0.6674 0.7959 0.7959 2.1552 2.1552 2.2477 2.2477 2.4818 2.4818 2.6151 2.6151 2.7715 2.7715 2.8939 2.8939 3.0651 3.0651 3.1737 3.1737 3.4292 3.4292 3.4971 3.4971 4.8998 4.8998 5.9396 5.9396 7.6910 7.6910 8.3313 8.3313 8.8070 8.8070 9.1447 9.1447 9.4121 9.4121 k =-0.4070-0.0322 0.1375 ( 7824 PWs) bands (ev): -17.3803 -17.3803 -15.5419 -15.5419 -12.2813 -12.2813 -11.2549 -11.2549 -11.1953 -11.1953 -9.4292 -9.4292 -9.3079 -9.3079 -6.3219 -6.3219 -5.6071 -5.6071 -5.1708 -5.1708 -3.7410 -3.7410 -3.5907 -3.5907 -2.4739 -2.4739 -2.0835 -2.0835 -1.5209 -1.5209 -1.1612 -1.1612 -0.8347 -0.8347 -0.2507 -0.2507 -0.0884 -0.0884 0.1004 0.1004 0.5723 0.5723 0.6625 0.6625 0.8026 0.8026 2.1598 2.1598 2.2441 2.2441 2.4841 2.4841 2.6084 2.6084 2.7761 2.7761 2.8959 2.8959 3.0450 3.0450 3.1528 3.1528 3.4263 3.4263 3.4933 3.4933 4.9031 4.9031 5.9365 5.9365 7.7288 7.7288 8.2974 8.2974 8.7886 8.7886 9.1520 9.1520 9.3867 9.3867 k =-0.4186-0.0331 0.1415 ( 7826 PWs) bands (ev): -17.3788 -17.3788 -15.5409 -15.5409 -12.2815 -12.2815 -11.2475 -11.2475 -11.1951 -11.1951 -9.4285 -9.4285 -9.3079 -9.3079 -6.3217 -6.3217 -5.6075 -5.6075 -5.1704 -5.1704 -3.7531 -3.7531 -3.5919 -3.5919 -2.4731 -2.4731 -2.0870 -2.0870 -1.5311 -1.5311 -1.1689 -1.1689 -0.8504 -0.8504 -0.2428 -0.2428 -0.0862 -0.0862 0.0963 0.0963 0.5790 0.5790 0.6572 0.6572 0.8087 0.8087 2.1639 2.1639 2.2411 2.2411 2.4873 2.4873 2.6018 2.6018 2.7809 2.7809 2.8986 2.8986 3.0257 3.0257 3.1329 3.1329 3.4239 3.4239 3.4900 3.4900 4.9061 4.9061 5.9336 5.9336 7.7647 7.7647 8.2652 8.2652 8.7718 8.7718 9.1595 9.1595 9.3623 9.3623 k =-0.4302-0.0341 0.1454 ( 7822 PWs) bands (ev): -17.3776 -17.3776 -15.5401 -15.5401 -12.2817 -12.2817 -11.2404 -11.2404 -11.1954 -11.1954 -9.4278 -9.4278 -9.3079 -9.3079 -6.3216 -6.3216 -5.6079 -5.6079 -5.1700 -5.1700 -3.7638 -3.7638 -3.5928 -3.5928 -2.4724 -2.4724 -2.0903 -2.0903 -1.5400 -1.5400 -1.1760 -1.1760 -0.8640 -0.8640 -0.2361 -0.2361 -0.0826 -0.0826 0.0921 0.0921 0.5852 0.5852 0.6518 0.6518 0.8141 0.8141 2.1676 2.1676 2.2386 2.2386 2.4914 2.4914 2.5954 2.5954 2.7858 2.7858 2.9019 2.9019 3.0073 3.0073 3.1143 3.1143 3.4218 3.4218 3.4871 3.4871 4.9089 4.9089 5.9309 5.9309 7.7987 7.7987 8.2347 8.2347 8.7569 8.7569 9.1675 9.1675 9.3392 9.3392 k =-0.4419-0.0350 0.1493 ( 7823 PWs) bands (ev): -17.3765 -17.3765 -15.5394 -15.5394 -12.2819 -12.2819 -11.2339 -11.2339 -11.1963 -11.1963 -9.4272 -9.4272 -9.3079 -9.3079 -6.3215 -6.3215 -5.6082 -5.6082 -5.1696 -5.1696 -3.7731 -3.7731 -3.5935 -3.5935 -2.4718 -2.4718 -2.0931 -2.0931 -1.5476 -1.5476 -1.1825 -1.1825 -0.8755 -0.8755 -0.2307 -0.2307 -0.0778 -0.0778 0.0879 0.0879 0.5908 0.5908 0.6464 0.6464 0.8189 0.8189 2.1707 2.1707 2.2365 2.2365 2.4960 2.4960 2.5893 2.5893 2.7905 2.7905 2.9058 2.9058 2.9903 2.9903 3.0973 3.0973 3.4201 3.4201 3.4847 3.4847 4.9113 4.9113 5.9285 5.9285 7.8307 7.8307 8.2060 8.2060 8.7441 8.7441 9.1759 9.1759 9.3174 9.3174 k =-0.4535-0.0359 0.1533 ( 7828 PWs) bands (ev): -17.3757 -17.3757 -15.5388 -15.5388 -12.2821 -12.2821 -11.2278 -11.2278 -11.1976 -11.1976 -9.4268 -9.4268 -9.3079 -9.3079 -6.3215 -6.3215 -5.6084 -5.6084 -5.1693 -5.1693 -3.7807 -3.7807 -3.5939 -3.5939 -2.4713 -2.4713 -2.0955 -2.0955 -1.5539 -1.5539 -1.1880 -1.1880 -0.8848 -0.8848 -0.2266 -0.2266 -0.0725 -0.0725 0.0839 0.0839 0.5960 0.5960 0.6412 0.6412 0.8229 0.8229 2.1732 2.1732 2.2349 2.2349 2.5009 2.5009 2.5835 2.5835 2.7950 2.7950 2.9102 2.9102 2.9749 2.9749 3.0823 3.0823 3.4187 3.4187 3.4827 3.4827 4.9133 4.9133 5.9265 5.9265 7.8600 7.8600 8.1793 8.1793 8.7334 8.7334 9.1848 9.1848 9.2971 9.2971 k =-0.4651-0.0368 0.1572 ( 7833 PWs) bands (ev): -17.3750 -17.3750 -15.5383 -15.5383 -12.2822 -12.2822 -11.2222 -11.2222 -11.1995 -11.1995 -9.4264 -9.4264 -9.3079 -9.3079 -6.3214 -6.3214 -5.6086 -5.6086 -5.1690 -5.1690 -3.7868 -3.7868 -3.5943 -3.5943 -2.4710 -2.4710 -2.0974 -2.0974 -1.5589 -1.5589 -1.1924 -1.1924 -0.8921 -0.8921 -0.2237 -0.2237 -0.0673 -0.0673 0.0802 0.0802 0.6006 0.6006 0.6363 0.6363 0.8261 0.8261 2.1752 2.1752 2.2337 2.2337 2.5058 2.5058 2.5782 2.5782 2.7990 2.7990 2.9151 2.9151 2.9613 2.9613 3.0697 3.0697 3.4176 3.4176 3.4811 3.4811 4.9148 4.9148 5.9249 5.9249 7.8862 7.8862 8.1554 8.1554 8.7249 8.7249 9.1945 9.1945 9.2784 9.2784 k =-0.4767-0.0377 0.1611 ( 7829 PWs) bands (ev): -17.3745 -17.3745 -15.5380 -15.5380 -12.2823 -12.2823 -11.2171 -11.2171 -11.2018 -11.2018 -9.4262 -9.4262 -9.3079 -9.3079 -6.3214 -6.3214 -5.6088 -5.6088 -5.1689 -5.1689 -3.7911 -3.7911 -3.5945 -3.5945 -2.4707 -2.4707 -2.0988 -2.0988 -1.5624 -1.5624 -1.1957 -1.1957 -0.8973 -0.8973 -0.2217 -0.2217 -0.0629 -0.0629 0.0773 0.0773 0.6047 0.6047 0.6319 0.6319 0.8284 0.8284 2.1766 2.1766 2.2329 2.2329 2.5101 2.5101 2.5738 2.5738 2.8022 2.8022 2.9204 2.9204 2.9499 2.9499 3.0602 3.0602 3.4168 3.4168 3.4801 3.4801 4.9160 4.9160 5.9237 5.9237 7.9077 7.9077 8.1355 8.1355 8.7189 8.7189 9.2049 9.2049 9.2614 9.2614 k =-0.4884-0.0387 0.1651 ( 7831 PWs) bands (ev): -17.3742 -17.3742 -15.5378 -15.5378 -12.2823 -12.2823 -11.2126 -11.2126 -11.2047 -11.2047 -9.4260 -9.4260 -9.3079 -9.3079 -6.3213 -6.3213 -5.6088 -5.6088 -5.1687 -5.1687 -3.7937 -3.7937 -3.5946 -3.5946 -2.4706 -2.4706 -2.0997 -2.0997 -1.5645 -1.5645 -1.1977 -1.1977 -0.9004 -0.9004 -0.2206 -0.2206 -0.0599 -0.0599 0.0753 0.0753 0.6078 0.6078 0.6286 0.6286 0.8298 0.8298 2.1775 2.1775 2.2324 2.2324 2.5130 2.5130 2.5708 2.5708 2.8043 2.8043 2.9262 2.9262 2.9404 2.9404 3.0541 3.0541 3.4164 3.4164 3.4794 3.4794 4.9167 4.9167 5.9230 5.9230 7.9225 7.9225 8.1218 8.1218 8.7152 8.7152 9.2159 9.2159 9.2464 9.2464 k =-0.5000-0.0396 0.1690 ( 7828 PWs) bands (ev): -17.3741 -17.3741 -15.5377 -15.5377 -12.2823 -12.2823 -11.2096 -11.2096 -11.2072 -11.2072 -9.4260 -9.4260 -9.3079 -9.3079 -6.3213 -6.3213 -5.6089 -5.6089 -5.1687 -5.1687 -3.7946 -3.7946 -3.5947 -3.5947 -2.4705 -2.4705 -2.1000 -2.1000 -1.5653 -1.5653 -1.1983 -1.1983 -0.9014 -0.9014 -0.2203 -0.2203 -0.0588 -0.0588 0.0746 0.0746 0.6090 0.6090 0.6273 0.6273 0.8302 0.8302 2.1778 2.1778 2.2322 2.2322 2.5141 2.5141 2.5697 2.5697 2.8051 2.8051 2.9320 2.9320 2.9334 2.9334 3.0520 3.0520 3.4162 3.4162 3.4792 3.4792 4.9169 4.9169 5.9228 5.9228 7.9278 7.9278 8.1167 8.1167 8.7140 8.7140 9.2237 9.2237 9.2373 9.2373 k =-0.5000-0.3220 0.0729 ( 7838 PWs) bands (ev): -17.3730 -17.3730 -15.5390 -15.5390 -12.2916 -12.2916 -11.2059 -11.2059 -11.2056 -11.2056 -9.4273 -9.4273 -9.2973 -9.2973 -6.2653 -6.2653 -5.5991 -5.5991 -5.2233 -5.2233 -3.8015 -3.8015 -3.6548 -3.6548 -2.4615 -2.4615 -2.0691 -2.0691 -1.5091 -1.5091 -1.3770 -1.3770 -0.9291 -0.9291 -0.2375 -0.2375 -0.0083 -0.0083 0.1586 0.1586 0.6061 0.6061 0.6811 0.6811 0.8264 0.8264 2.1870 2.1870 2.2160 2.2160 2.4415 2.4415 2.6048 2.6048 2.8483 2.8483 2.9385 2.9385 3.0439 3.0439 3.1139 3.1139 3.4689 3.4689 3.5412 3.5412 4.6536 4.6536 5.8274 5.8274 7.7696 7.7696 8.2863 8.2863 8.8839 8.8839 9.2920 9.2920 9.5166 9.5166 k =-0.4898-0.3154 0.0714 ( 7840 PWs) bands (ev): -17.3731 -17.3731 -15.5390 -15.5390 -12.2916 -12.2916 -11.2089 -11.2089 -11.2031 -11.2031 -9.4273 -9.4273 -9.2973 -9.2973 -6.2654 -6.2654 -5.5990 -5.5990 -5.2233 -5.2233 -3.8008 -3.8008 -3.6547 -3.6547 -2.4616 -2.4616 -2.0689 -2.0689 -1.5086 -1.5086 -1.3764 -1.3764 -0.9286 -0.9286 -0.2375 -0.2375 -0.0075 -0.0075 0.1587 0.1587 0.6046 0.6046 0.6812 0.6812 0.8261 0.8261 2.1868 2.1868 2.2162 2.2162 2.4415 2.4415 2.6049 2.6049 2.8471 2.8471 2.9408 2.9408 3.0412 3.0412 3.1167 3.1167 3.4690 3.4690 3.5410 3.5410 4.6546 4.6546 5.8276 5.8276 7.7695 7.7695 8.2867 8.2867 8.8849 8.8849 9.2921 9.2921 9.5169 9.5169 k =-0.4796-0.3088 0.0699 ( 7842 PWs) bands (ev): -17.3733 -17.3733 -15.5392 -15.5392 -12.2915 -12.2915 -11.2124 -11.2124 -11.2009 -11.2009 -9.4274 -9.4274 -9.2974 -9.2974 -6.2658 -6.2658 -5.5990 -5.5990 -5.2232 -5.2232 -3.7985 -3.7985 -3.6545 -3.6545 -2.4617 -2.4617 -2.0685 -2.0685 -1.5072 -1.5072 -1.3746 -1.3746 -0.9271 -0.9271 -0.2373 -0.2373 -0.0052 -0.0052 0.1590 0.1590 0.6002 0.6002 0.6815 0.6815 0.8253 0.8253 2.1861 2.1861 2.2167 2.2167 2.4418 2.4418 2.6050 2.6050 2.8438 2.8438 2.9472 2.9472 3.0342 3.0342 3.1241 3.1241 3.4695 3.4695 3.5406 3.5406 4.6576 4.6576 5.8282 5.8282 7.7691 7.7691 8.2876 8.2876 8.8882 8.8882 9.2925 9.2925 9.5180 9.5180 k =-0.4694-0.3023 0.0684 ( 7840 PWs) bands (ev): -17.3737 -17.3737 -15.5394 -15.5394 -12.2914 -12.2914 -11.2163 -11.2163 -11.1992 -11.1992 -9.4275 -9.4275 -9.2974 -9.2974 -6.2662 -6.2662 -5.5989 -5.5989 -5.2230 -5.2230 -3.7947 -3.7947 -3.6540 -3.6540 -2.4618 -2.4618 -2.0679 -2.0679 -1.5048 -1.5048 -1.3715 -1.3715 -0.9244 -0.9244 -0.2371 -0.2371 -0.0016 -0.0016 0.1596 0.1596 0.5932 0.5932 0.6815 0.6815 0.8239 0.8239 2.1849 2.1849 2.2174 2.2174 2.4421 2.4421 2.6053 2.6053 2.8393 2.8393 2.9568 2.9568 3.0251 3.0251 3.1343 3.1343 3.4704 3.4704 3.5399 3.5399 4.6625 4.6625 5.8291 5.8291 7.7684 7.7684 8.2894 8.2894 8.8936 8.8936 9.2930 9.2930 9.5197 9.5197 k =-0.4592-0.2957 0.0669 ( 7840 PWs) bands (ev): -17.3743 -17.3743 -15.5398 -15.5398 -12.2913 -12.2913 -11.2206 -11.2206 -11.1979 -11.1979 -9.4276 -9.4276 -9.2975 -9.2975 -6.2669 -6.2669 -5.5989 -5.5989 -5.2228 -5.2228 -3.7895 -3.7895 -3.6534 -3.6534 -2.4620 -2.4620 -2.0670 -2.0670 -1.5015 -1.5015 -1.3674 -1.3674 -0.9206 -0.9206 -0.2367 -0.2367 0.0033 0.0033 0.1603 0.1603 0.5842 0.5842 0.6809 0.6809 0.8221 0.8221 2.1833 2.1833 2.2185 2.2185 2.4427 2.4427 2.6057 2.6057 2.8342 2.8342 2.9678 2.9678 3.0159 3.0159 3.1460 3.1460 3.4715 3.4715 3.5390 3.5390 4.6693 4.6693 5.8304 5.8304 7.7671 7.7671 8.2919 8.2919 8.9011 8.9011 9.2937 9.2937 9.5220 9.5220 k =-0.4490-0.2891 0.0654 ( 7838 PWs) bands (ev): -17.3749 -17.3749 -15.5402 -15.5402 -12.2911 -12.2911 -11.2253 -11.2253 -11.1970 -11.1970 -9.4278 -9.4278 -9.2976 -9.2976 -6.2678 -6.2678 -5.5988 -5.5988 -5.2225 -5.2225 -3.7829 -3.7829 -3.6526 -3.6526 -2.4623 -2.4623 -2.0658 -2.0658 -1.4972 -1.4972 -1.3621 -1.3621 -0.9156 -0.9156 -0.2361 -0.2361 0.0092 0.0092 0.1613 0.1613 0.5735 0.5735 0.6795 0.6795 0.8200 0.8200 2.1813 2.1813 2.2200 2.2200 2.4434 2.4434 2.6064 2.6064 2.8290 2.8290 2.9768 2.9768 3.0103 3.0103 3.1585 3.1585 3.4730 3.4730 3.5380 3.5380 4.6778 4.6778 5.8320 5.8320 7.7651 7.7651 8.2954 8.2954 8.9105 8.9105 9.2945 9.2945 9.5248 9.5248 k =-0.4388-0.2826 0.0640 ( 7839 PWs) bands (ev): -17.3758 -17.3758 -15.5408 -15.5408 -12.2909 -12.2909 -11.2304 -11.2304 -11.1965 -11.1965 -9.4280 -9.4280 -9.2977 -9.2977 -6.2689 -6.2689 -5.5986 -5.5986 -5.2222 -5.2222 -3.7749 -3.7749 -3.6516 -3.6516 -2.4627 -2.4627 -2.0643 -2.0643 -1.4920 -1.4920 -1.3559 -1.3559 -0.9093 -0.9093 -0.2352 -0.2352 0.0158 0.0158 0.1625 0.1625 0.5615 0.5615 0.6769 0.6769 0.8177 0.8177 2.1788 2.1788 2.2218 2.2218 2.4443 2.4443 2.6072 2.6072 2.8240 2.8240 2.9768 2.9768 3.0152 3.0152 3.1714 3.1714 3.4747 3.4747 3.5368 3.5368 4.6878 4.6878 5.8340 5.8340 7.7620 7.7620 8.3000 8.3000 8.9216 8.9216 9.2954 9.2954 9.5280 9.5280 k =-0.4286-0.2760 0.0625 ( 7844 PWs) bands (ev): -17.3768 -17.3768 -15.5414 -15.5414 -12.2906 -12.2906 -11.2358 -11.2358 -11.1965 -11.1965 -9.4282 -9.4282 -9.2979 -9.2979 -6.2701 -6.2701 -5.5985 -5.5985 -5.2218 -5.2218 -3.7655 -3.7655 -3.6503 -3.6503 -2.4632 -2.4632 -2.0626 -2.0626 -1.4860 -1.4860 -1.3488 -1.3488 -0.9015 -0.9015 -0.2341 -0.2341 0.0229 0.0229 0.1639 0.1639 0.5486 0.5486 0.6732 0.6732 0.8153 0.8153 2.1760 2.1760 2.2241 2.2241 2.4455 2.4455 2.6083 2.6083 2.8192 2.8192 2.9692 2.9692 3.0291 3.0291 3.1846 3.1846 3.4767 3.4767 3.5356 3.5356 4.6991 4.6991 5.8363 5.8363 7.7576 7.7576 8.3060 8.3060 8.9344 8.9344 9.2961 9.2961 9.5314 9.5314 k =-0.4184-0.2694 0.0610 ( 7839 PWs) bands (ev): -17.3779 -17.3779 -15.5421 -15.5421 -12.2903 -12.2903 -11.2416 -11.2416 -11.1969 -11.1969 -9.4285 -9.4285 -9.2980 -9.2980 -6.2715 -6.2715 -5.5983 -5.5983 -5.2213 -5.2213 -3.7550 -3.7550 -3.6488 -3.6488 -2.4637 -2.4637 -2.0607 -2.0607 -1.4790 -1.4790 -1.3410 -1.3410 -0.8922 -0.8922 -0.2326 -0.2326 0.0300 0.0300 0.1655 0.1655 0.5351 0.5351 0.6682 0.6682 0.8127 0.8127 2.1728 2.1728 2.2268 2.2268 2.4469 2.4469 2.6096 2.6096 2.8146 2.8146 2.9596 2.9596 3.0465 3.0465 3.1980 3.1980 3.4789 3.4789 3.5345 3.5345 4.7116 4.7116 5.8389 5.8389 7.7514 7.7514 8.3137 8.3137 8.9486 8.9486 9.2967 9.2967 9.5350 9.5350 k =-0.4082-0.2628 0.0595 ( 7838 PWs) bands (ev): -17.3791 -17.3791 -15.5429 -15.5429 -12.2900 -12.2900 -11.2477 -11.2477 -11.1977 -11.1977 -9.4288 -9.4288 -9.2982 -9.2982 -6.2730 -6.2730 -5.5981 -5.5981 -5.2208 -5.2208 -3.7433 -3.7433 -3.6468 -3.6468 -2.4643 -2.4643 -2.0585 -2.0585 -1.4712 -1.4712 -1.3325 -1.3325 -0.8813 -0.8813 -0.2308 -0.2308 0.0369 0.0369 0.1673 0.1673 0.5212 0.5212 0.6621 0.6621 0.8101 0.8101 2.1693 2.1693 2.2301 2.2301 2.4487 2.4487 2.6112 2.6112 2.8103 2.8103 2.9499 2.9499 3.0653 3.0653 3.2114 3.2114 3.4814 3.4814 3.5335 3.5335 4.7250 4.7250 5.8418 5.8418 7.7430 7.7430 8.3233 8.3233 8.9639 8.9639 9.2970 9.2970 9.5385 9.5385 k =-0.3980-0.2563 0.0580 ( 7837 PWs) bands (ev): -17.3805 -17.3805 -15.5438 -15.5438 -12.2896 -12.2896 -11.2541 -11.2541 -11.1989 -11.1989 -9.4292 -9.4292 -9.2984 -9.2984 -6.2746 -6.2746 -5.5979 -5.5979 -5.2202 -5.2202 -3.7308 -3.7308 -3.6444 -3.6444 -2.4650 -2.4650 -2.0561 -2.0561 -1.4625 -1.4625 -1.3235 -1.3235 -0.8687 -0.8687 -0.2286 -0.2286 0.0433 0.0433 0.1693 0.1693 0.5074 0.5074 0.6552 0.6552 0.8074 0.8074 2.1655 2.1655 2.2338 2.2338 2.4508 2.4508 2.6131 2.6131 2.8060 2.8060 2.9407 2.9407 3.0849 3.0849 3.2250 3.2250 3.4840 3.4840 3.5329 3.5329 4.7392 4.7392 5.8450 5.8450 7.7321 7.7321 8.3353 8.3353 8.9800 8.9800 9.2969 9.2969 9.5419 9.5419 k =-0.3878-0.2497 0.0565 ( 7839 PWs) bands (ev): -17.3820 -17.3820 -15.5448 -15.5448 -12.2892 -12.2892 -11.2608 -11.2608 -11.2005 -11.2005 -9.4296 -9.4296 -9.2986 -9.2986 -6.2764 -6.2764 -5.5977 -5.5977 -5.2196 -5.2196 -3.7177 -3.7177 -3.6413 -3.6413 -2.4659 -2.4659 -2.0535 -2.0535 -1.4530 -1.4530 -1.3142 -1.3142 -0.8543 -0.8543 -0.2260 -0.2260 0.0488 0.0488 0.1713 0.1713 0.4939 0.4939 0.6475 0.6475 0.8045 0.8045 2.1616 2.1616 2.2381 2.2381 2.4532 2.4532 2.6152 2.6152 2.8018 2.8018 2.9323 2.9323 3.1048 3.1048 3.2386 3.2386 3.4867 3.4867 3.5328 3.5328 4.7537 4.7537 5.8485 5.8485 7.7181 7.7181 8.3499 8.3499 8.9965 8.9965 9.2963 9.2963 9.5448 9.5448 k =-0.3776-0.2431 0.0550 ( 7836 PWs) bands (ev): -17.3836 -17.3836 -15.5459 -15.5459 -12.2888 -12.2888 -11.2678 -11.2678 -11.2024 -11.2024 -9.4301 -9.4301 -9.2989 -9.2989 -6.2783 -6.2783 -5.5975 -5.5975 -5.2189 -5.2189 -3.7044 -3.7044 -3.6371 -3.6371 -2.4669 -2.4669 -2.0507 -2.0507 -1.4427 -1.4427 -1.3046 -1.3046 -0.8380 -0.8380 -0.2231 -0.2231 0.0531 0.0531 0.1733 0.1733 0.4810 0.4810 0.6394 0.6394 0.8015 0.8015 2.1574 2.1574 2.2430 2.2430 2.4562 2.4562 2.6174 2.6174 2.7975 2.7975 2.9250 2.9250 3.1248 3.1248 3.2523 3.2523 3.4895 3.4895 3.5333 3.5333 4.7686 4.7686 5.8521 5.8521 7.7009 7.7009 8.3676 8.3676 9.0132 9.0132 9.2951 9.2951 9.5473 9.5473 k =-0.3673-0.2366 0.0535 ( 7830 PWs) bands (ev): -17.3853 -17.3853 -15.5470 -15.5470 -12.2884 -12.2884 -11.2750 -11.2750 -11.2046 -11.2046 -9.4306 -9.4306 -9.2992 -9.2992 -6.2802 -6.2802 -5.5973 -5.5973 -5.2181 -5.2181 -3.6917 -3.6917 -3.6310 -3.6310 -2.4679 -2.4679 -2.0478 -2.0478 -1.4317 -1.4317 -1.2949 -1.2949 -0.8199 -0.8199 -0.2198 -0.2198 0.0561 0.0561 0.1751 0.1751 0.4691 0.4691 0.6311 0.6311 0.7983 0.7983 2.1530 2.1530 2.2485 2.2485 2.4597 2.4597 2.6198 2.6198 2.7931 2.7931 2.9187 2.9187 3.1446 3.1446 3.2662 3.2662 3.4923 3.4923 3.5346 3.5346 4.7835 4.7835 5.8560 5.8560 7.6801 7.6801 8.3886 8.3886 9.0295 9.0295 9.2932 9.2932 9.5492 9.5492 k =-0.3571-0.2300 0.0521 ( 7833 PWs) bands (ev): -17.3872 -17.3872 -15.5482 -15.5482 -12.2879 -12.2879 -11.2824 -11.2824 -11.2072 -11.2072 -9.4311 -9.4311 -9.2995 -9.2995 -6.2822 -6.2822 -5.5970 -5.5970 -5.2173 -5.2173 -3.6805 -3.6805 -3.6223 -3.6223 -2.4691 -2.4691 -2.0447 -2.0447 -1.4199 -1.4199 -1.2852 -1.2852 -0.7999 -0.7999 -0.2162 -0.2162 0.0577 0.0577 0.1767 0.1767 0.4583 0.4583 0.6229 0.6229 0.7948 0.7948 2.1485 2.1485 2.2546 2.2546 2.4637 2.4637 2.6223 2.6223 2.7886 2.7886 2.9137 2.9137 3.1638 3.1638 3.2803 3.2803 3.4950 3.4950 3.5367 3.5367 4.7982 4.7982 5.8600 5.8600 7.6556 7.6556 8.4130 8.4130 9.0449 9.0449 9.2904 9.2904 9.5503 9.5503 k =-0.3469-0.2234 0.0506 ( 7835 PWs) bands (ev): -17.3891 -17.3891 -15.5494 -15.5494 -12.2875 -12.2875 -11.2901 -11.2901 -11.2100 -11.2100 -9.4318 -9.4318 -9.2998 -9.2998 -6.2843 -6.2843 -5.5968 -5.5968 -5.2165 -5.2165 -3.6715 -3.6715 -3.6103 -3.6103 -2.4704 -2.4704 -2.0416 -2.0416 -1.4075 -1.4075 -1.2757 -1.2757 -0.7781 -0.7781 -0.2124 -0.2124 0.0578 0.0578 0.1779 0.1779 0.4487 0.4487 0.6151 0.6151 0.7910 0.7910 2.1439 2.1439 2.2614 2.2614 2.4683 2.4683 2.6249 2.6249 2.7841 2.7841 2.9098 2.9098 3.1823 3.1823 3.2946 3.2946 3.4977 3.4977 3.5399 3.5399 4.8126 4.8126 5.8641 5.8641 7.6273 7.6273 8.4410 8.4410 9.0590 9.0590 9.2869 9.2869 9.5507 9.5507 k =-0.3367-0.2168 0.0491 ( 7836 PWs) bands (ev): -17.3911 -17.3911 -15.5507 -15.5507 -12.2870 -12.2870 -11.2979 -11.2979 -11.2130 -11.2130 -9.4324 -9.4324 -9.3001 -9.3001 -6.2864 -6.2864 -5.5965 -5.5965 -5.2156 -5.2156 -3.6649 -3.6649 -3.5950 -3.5950 -2.4719 -2.4719 -2.0385 -2.0385 -1.3944 -1.3944 -1.2663 -1.2663 -0.7545 -0.7545 -0.2083 -0.2083 0.0565 0.0565 0.1788 0.1788 0.4403 0.4403 0.6079 0.6079 0.7868 0.7868 2.1393 2.1393 2.2688 2.2688 2.4736 2.4736 2.6275 2.6275 2.7795 2.7795 2.9070 2.9070 3.1998 3.1998 3.3092 3.3092 3.5004 3.5004 3.5440 3.5440 4.8264 4.8264 5.8683 5.8683 7.5955 7.5955 8.4726 8.4726 9.0712 9.0712 9.2826 9.2826 9.5501 9.5501 k =-0.3265-0.2103 0.0476 ( 7836 PWs) bands (ev): -17.3932 -17.3932 -15.5521 -15.5521 -12.2865 -12.2865 -11.3059 -11.3059 -11.2163 -11.2163 -9.4332 -9.4332 -9.3004 -9.3004 -6.2885 -6.2885 -5.5962 -5.5962 -5.2146 -5.2146 -3.6601 -3.6601 -3.5770 -3.5770 -2.4734 -2.4734 -2.0353 -2.0353 -1.3808 -1.3808 -1.2574 -1.2574 -0.7294 -0.7294 -0.2041 -0.2041 0.0540 0.0540 0.1793 0.1793 0.4328 0.4328 0.6016 0.6016 0.7824 0.7824 2.1346 2.1346 2.2767 2.2767 2.4795 2.4795 2.6301 2.6301 2.7751 2.7751 2.9052 2.9052 3.2162 3.2162 3.3242 3.3242 3.5032 3.5032 3.5490 3.5490 4.8396 4.8396 5.8725 5.8725 7.5601 7.5601 8.5078 8.5078 9.0811 9.0811 9.2777 9.2777 9.5485 9.5485 k =-0.3163-0.2037 0.0461 ( 7831 PWs) bands (ev): -17.3954 -17.3954 -15.5535 -15.5535 -12.2860 -12.2860 -11.3141 -11.3141 -11.2197 -11.2197 -9.4340 -9.4340 -9.3008 -9.3008 -6.2907 -6.2907 -5.5960 -5.5960 -5.2137 -5.2137 -3.6564 -3.6564 -3.5569 -3.5569 -2.4751 -2.4751 -2.0322 -2.0322 -1.3665 -1.3665 -1.2489 -1.2489 -0.7028 -0.7028 -0.1997 -0.1997 0.0505 0.0505 0.1797 0.1797 0.4261 0.4261 0.5964 0.5964 0.7776 0.7776 2.1300 2.1300 2.2853 2.2853 2.4861 2.4861 2.6327 2.6327 2.7708 2.7708 2.9043 2.9043 3.2313 3.2313 3.3396 3.3396 3.5063 3.5063 3.5548 3.5548 4.8520 4.8520 5.8767 5.8767 7.5215 7.5215 8.5464 8.5464 9.0882 9.0882 9.2722 9.2722 9.5458 9.5458 k =-0.3061-0.1971 0.0446 ( 7825 PWs) bands (ev): -17.3976 -17.3976 -15.5549 -15.5549 -12.2854 -12.2854 -11.3224 -11.3224 -11.2233 -11.2233 -9.4348 -9.4348 -9.3012 -9.3012 -6.2928 -6.2928 -5.5957 -5.5957 -5.2126 -5.2126 -3.6535 -3.6535 -3.5353 -3.5353 -2.4769 -2.4769 -2.0292 -2.0292 -1.3519 -1.3519 -1.2410 -1.2410 -0.6749 -0.6749 -0.1951 -0.1951 0.0464 0.0464 0.1800 0.1800 0.4199 0.4199 0.5925 0.5925 0.7725 0.7725 2.1253 2.1253 2.2945 2.2945 2.4934 2.4934 2.6352 2.6352 2.7668 2.7668 2.9043 2.9043 3.2451 3.2451 3.3554 3.3554 3.5099 3.5099 3.5614 3.5614 4.8635 4.8635 5.8808 5.8808 7.4798 7.4798 8.5881 8.5881 9.0922 9.0922 9.2664 9.2664 9.5419 9.5419 k =-0.2959-0.1906 0.0431 ( 7821 PWs) bands (ev): -17.3998 -17.3998 -15.5564 -15.5564 -12.2849 -12.2849 -11.3308 -11.3308 -11.2270 -11.2270 -9.4357 -9.4357 -9.3016 -9.3016 -6.2950 -6.2950 -5.5955 -5.5955 -5.2115 -5.2115 -3.6510 -3.6510 -3.5125 -3.5125 -2.4788 -2.4788 -2.0263 -2.0263 -1.3367 -1.3367 -1.2339 -1.2339 -0.6459 -0.6459 -0.1903 -0.1903 0.0422 0.0422 0.1803 0.1803 0.4138 0.4138 0.5897 0.5897 0.7670 0.7670 2.1207 2.1207 2.3042 2.3042 2.5015 2.5015 2.6377 2.6377 2.7631 2.7631 2.9050 2.9050 3.2576 3.2576 3.3713 3.3713 3.5139 3.5139 3.5686 3.5686 4.8739 4.8739 5.8847 5.8847 7.4353 7.4353 8.6327 8.6327 9.0928 9.0928 9.2608 9.2608 9.5363 9.5363 k =-0.2857-0.1840 0.0416 ( 7818 PWs) bands (ev): -17.4022 -17.4022 -15.5579 -15.5579 -12.2844 -12.2844 -11.3393 -11.3393 -11.2308 -11.2308 -9.4367 -9.4367 -9.3020 -9.3020 -6.2971 -6.2971 -5.5952 -5.5952 -5.2104 -5.2104 -3.6489 -3.6489 -3.4889 -3.4889 -2.4808 -2.4808 -2.0236 -2.0236 -1.3213 -1.3213 -1.2277 -1.2277 -0.6161 -0.6161 -0.1853 -0.1853 0.0383 0.0383 0.1806 0.1806 0.4076 0.4076 0.5881 0.5881 0.7613 0.7613 2.1162 2.1162 2.3144 2.3144 2.5102 2.5102 2.6402 2.6402 2.7597 2.7597 2.9063 2.9063 3.2689 3.2689 3.3874 3.3874 3.5186 3.5186 3.5762 3.5762 4.8833 4.8833 5.8885 5.8885 7.3883 7.3883 8.6796 8.6796 9.0901 9.0901 9.2558 9.2558 9.5289 9.5289 k =-0.2755-0.1774 0.0402 ( 7829 PWs) bands (ev): -17.4045 -17.4045 -15.5594 -15.5594 -12.2838 -12.2838 -11.3478 -11.3478 -11.2346 -11.2346 -9.4377 -9.4377 -9.3024 -9.3024 -6.2991 -6.2991 -5.5949 -5.5949 -5.2093 -5.2093 -3.6469 -3.6469 -3.4645 -3.4645 -2.4829 -2.4829 -2.0210 -2.0210 -1.3055 -1.3055 -1.2225 -1.2225 -0.5857 -0.5857 -0.1800 -0.1800 0.0352 0.0352 0.1811 0.1811 0.4013 0.4013 0.5874 0.5874 0.7552 0.7552 2.1118 2.1118 2.3249 2.3249 2.5196 2.5196 2.6426 2.6426 2.7568 2.7568 2.9083 2.9083 3.2792 3.2792 3.4033 3.4033 3.5239 3.5239 3.5841 3.5841 4.8917 4.8917 5.8921 5.8921 7.3390 7.3390 8.7281 8.7281 9.0844 9.0844 9.2521 9.2521 9.5192 9.5192 k =-0.2653-0.1708 0.0387 ( 7827 PWs) bands (ev): -17.4069 -17.4069 -15.5609 -15.5609 -12.2833 -12.2833 -11.3564 -11.3564 -11.2385 -11.2385 -9.4387 -9.4387 -9.3028 -9.3028 -6.3012 -6.3012 -5.5947 -5.5947 -5.2081 -5.2081 -3.6451 -3.6451 -3.4395 -3.4395 -2.4851 -2.4851 -2.0186 -2.0186 -1.2896 -1.2896 -1.2184 -1.2184 -0.5551 -0.5551 -0.1742 -0.1742 0.0332 0.0332 0.1817 0.1817 0.3947 0.3947 0.5876 0.5876 0.7489 0.7489 2.1075 2.1075 2.3359 2.3359 2.5296 2.5296 2.6452 2.6452 2.7544 2.7544 2.9109 2.9109 3.2887 3.2887 3.4190 3.4190 3.5300 3.5300 3.5923 3.5923 4.8989 4.8989 5.8953 5.8953 7.2877 7.2877 8.7771 8.7771 9.0761 9.0761 9.2505 9.2505 9.5066 9.5066 k =-0.2551-0.1643 0.0372 ( 7827 PWs) bands (ev): -17.4092 -17.4092 -15.5625 -15.5625 -12.2828 -12.2828 -11.3650 -11.3650 -11.2423 -11.2423 -9.4399 -9.4399 -9.3032 -9.3032 -6.3032 -6.3032 -5.5944 -5.5944 -5.2069 -5.2069 -3.6434 -3.6434 -3.4140 -3.4140 -2.4873 -2.4873 -2.0165 -2.0165 -1.2735 -1.2735 -1.2156 -1.2156 -0.5245 -0.5245 -0.1677 -0.1677 0.0325 0.0325 0.1824 0.1824 0.3879 0.3879 0.5882 0.5882 0.7423 0.7423 2.1035 2.1035 2.3471 2.3471 2.5401 2.5401 2.6479 2.6479 2.7523 2.7523 2.9140 2.9140 3.2974 3.2974 3.4343 3.4343 3.5369 3.5369 3.6007 3.6007 4.9050 4.9050 5.8983 5.8983 7.2346 7.2346 8.8251 8.8251 9.0662 9.0662 9.2519 9.2519 9.4905 9.4905 k =-0.2449-0.1577 0.0357 ( 7828 PWs) bands (ev): -17.4116 -17.4116 -15.5640 -15.5640 -12.2823 -12.2823 -11.3736 -11.3736 -11.2461 -11.2461 -9.4410 -9.4410 -9.3037 -9.3037 -6.3051 -6.3051 -5.5942 -5.5942 -5.2058 -5.2058 -3.6418 -3.6418 -3.3882 -3.3882 -2.4896 -2.4896 -2.0145 -2.0145 -1.2576 -1.2576 -1.2141 -1.2141 -0.4943 -0.4943 -0.1602 -0.1602 0.0334 0.0334 0.1833 0.1833 0.3811 0.3811 0.5891 0.5891 0.7355 0.7355 2.0995 2.0995 2.3585 2.3585 2.5509 2.5509 2.6509 2.6509 2.7507 2.7507 2.9177 2.9177 3.3056 3.3056 3.4491 3.4491 3.5446 3.5446 3.6091 3.6091 4.9100 4.9100 5.9009 5.9009 7.1800 7.1800 8.8696 8.8696 9.0560 9.0560 9.2572 9.2572 9.4710 9.4710 k =-0.2347-0.1511 0.0342 ( 7830 PWs) bands (ev): -17.4140 -17.4140 -15.5656 -15.5656 -12.2817 -12.2817 -11.3821 -11.3821 -11.2499 -11.2499 -9.4422 -9.4422 -9.3041 -9.3041 -6.3070 -6.3070 -5.5939 -5.5939 -5.2045 -5.2045 -3.6401 -3.6401 -3.3621 -3.3621 -2.4920 -2.4920 -2.0127 -2.0127 -1.2421 -1.2421 -1.2135 -1.2135 -0.4647 -0.4647 -0.1514 -0.1514 0.0360 0.0360 0.1843 0.1843 0.3743 0.3743 0.5900 0.5900 0.7284 0.7284 2.0958 2.0958 2.3700 2.3700 2.5619 2.5619 2.6544 2.6544 2.7495 2.7495 2.9220 2.9220 3.3134 3.3134 3.4633 3.4633 3.5530 3.5530 3.6175 3.6175 4.9139 4.9139 5.9031 5.9031 7.1241 7.1241 8.9070 8.9070 9.0475 9.0475 9.2669 9.2669 9.4486 9.4486 k =-0.2245-0.1446 0.0327 ( 7831 PWs) bands (ev): -17.4164 -17.4164 -15.5671 -15.5671 -12.2812 -12.2812 -11.3906 -11.3906 -11.2536 -11.2536 -9.4434 -9.4434 -9.3046 -9.3046 -6.3087 -6.3087 -5.5937 -5.5937 -5.2033 -5.2033 -3.6386 -3.6386 -3.3359 -3.3359 -2.4944 -2.4944 -2.0111 -2.0111 -1.2293 -1.2293 -1.2120 -1.2120 -0.4361 -0.4361 -0.1412 -0.1412 0.0401 0.0401 0.1855 0.1855 0.3676 0.3676 0.5906 0.5906 0.7213 0.7213 2.0923 2.0923 2.3816 2.3816 2.5727 2.5727 2.6586 2.6586 2.7487 2.7487 2.9270 2.9270 3.3208 3.3208 3.4771 3.4771 3.5621 3.5621 3.6258 3.6258 4.9169 4.9169 5.9049 5.9049 7.0670 7.0670 8.9325 8.9325 9.0438 9.0438 9.2796 9.2796 9.4265 9.4265 k =-0.2143-0.1380 0.0312 ( 7835 PWs) bands (ev): -17.4187 -17.4187 -15.5686 -15.5686 -12.2807 -12.2807 -11.3990 -11.3990 -11.2572 -11.2572 -9.4447 -9.4447 -9.3051 -9.3051 -6.3105 -6.3105 -5.5934 -5.5934 -5.2021 -5.2021 -3.6370 -3.6370 -3.3097 -3.3097 -2.4968 -2.4968 -2.0098 -2.0098 -1.2255 -1.2255 -1.2031 -1.2031 -0.4088 -0.4088 -0.1293 -0.1293 0.0458 0.0458 0.1868 0.1868 0.3611 0.3611 0.5909 0.5909 0.7140 0.7140 2.0891 2.0891 2.3931 2.3931 2.5829 2.5829 2.6638 2.6638 2.7483 2.7483 2.9327 2.9327 3.3279 3.3279 3.4903 3.4903 3.5718 3.5718 3.6340 3.6340 4.9190 4.9190 5.9063 5.9063 7.0089 7.0089 8.9427 8.9427 9.0465 9.0465 9.2873 9.2873 9.4141 9.4141 k =-0.2041-0.1314 0.0297 ( 7838 PWs) bands (ev): -17.4210 -17.4210 -15.5701 -15.5701 -12.2802 -12.2802 -11.4073 -11.4073 -11.2607 -11.2607 -9.4459 -9.4459 -9.3055 -9.3055 -6.3121 -6.3121 -5.5932 -5.5932 -5.2009 -5.2009 -3.6355 -3.6355 -3.2836 -3.2836 -2.4992 -2.4992 -2.0086 -2.0086 -1.2288 -1.2288 -1.1889 -1.1889 -0.3828 -0.3828 -0.1156 -0.1156 0.0529 0.0529 0.1883 0.1883 0.3550 0.3550 0.5905 0.5905 0.7066 0.7066 2.0860 2.0860 2.4044 2.4044 2.5920 2.5920 2.6705 2.6705 2.7482 2.7482 2.9392 2.9392 3.3347 3.3347 3.5031 3.5031 3.5820 3.5820 3.6420 3.6420 4.9202 4.9202 5.9072 5.9072 6.9501 6.9501 8.9403 8.9403 9.0522 9.0522 9.2768 9.2768 9.4251 9.4251 k =-0.1939-0.1248 0.0283 ( 7844 PWs) bands (ev): -17.4232 -17.4232 -15.5715 -15.5715 -12.2798 -12.2798 -11.4155 -11.4155 -11.2641 -11.2641 -9.4472 -9.4472 -9.3060 -9.3060 -6.3137 -6.3137 -5.5930 -5.5930 -5.1997 -5.1997 -3.6340 -3.6340 -3.2576 -3.2576 -2.5016 -2.5016 -2.0075 -2.0075 -1.2348 -1.2348 -1.1737 -1.1737 -0.3585 -0.3585 -0.1002 -0.1002 0.0613 0.0613 0.1900 0.1900 0.3493 0.3493 0.5895 0.5895 0.6992 0.6992 2.0833 2.0833 2.4155 2.4155 2.5997 2.5997 2.6785 2.6785 2.7484 2.7484 2.9468 2.9468 3.3412 3.3412 3.5155 3.5155 3.5925 3.5925 3.6498 3.6498 4.9206 4.9206 5.9078 5.9078 6.8907 6.8907 8.9304 8.9304 9.0552 9.0552 9.2495 9.2495 9.4578 9.4578 k =-0.1837-0.1183 0.0268 ( 7850 PWs) bands (ev): -17.4254 -17.4254 -15.5729 -15.5729 -12.2793 -12.2793 -11.4234 -11.4234 -11.2673 -11.2673 -9.4485 -9.4485 -9.3064 -9.3064 -6.3151 -6.3151 -5.5928 -5.5928 -5.1985 -5.1985 -3.6326 -3.6326 -3.2320 -3.2320 -2.5040 -2.5040 -2.0066 -2.0066 -1.2425 -1.2425 -1.1585 -1.1585 -0.3357 -0.3357 -0.0833 -0.0833 0.0707 0.0707 0.1919 0.1919 0.3442 0.3442 0.5877 0.5877 0.6918 0.6918 2.0807 2.0807 2.4263 2.4263 2.6058 2.6058 2.6879 2.6879 2.7491 2.7491 2.9555 2.9555 3.3474 3.3474 3.5277 3.5277 3.6033 3.6033 3.6574 3.6574 4.9204 4.9204 5.9079 5.9079 6.8311 6.8311 8.9159 8.9159 9.0509 9.0509 9.2182 9.2182 9.4998 9.4998 k =-0.1735-0.1117 0.0253 ( 7853 PWs) bands (ev): -17.4276 -17.4276 -15.5743 -15.5743 -12.2788 -12.2788 -11.4312 -11.4312 -11.2703 -11.2703 -9.4498 -9.4498 -9.3069 -9.3069 -6.3165 -6.3165 -5.5925 -5.5925 -5.1973 -5.1973 -3.6311 -3.6311 -3.2069 -3.2069 -2.5063 -2.5063 -2.0058 -2.0058 -1.2515 -1.2515 -1.1435 -1.1435 -0.3145 -0.3145 -0.0652 -0.0652 0.0810 0.0810 0.1940 0.1940 0.3397 0.3397 0.5850 0.5850 0.6845 0.6845 2.0785 2.0785 2.4369 2.4369 2.6104 2.6104 2.6983 2.6983 2.7502 2.7502 2.9655 2.9655 3.3532 3.3532 3.5395 3.5395 3.6145 3.6145 3.6648 3.6648 4.9196 4.9196 5.9076 5.9076 6.7713 6.7713 8.8972 8.8972 9.0362 9.0362 9.1928 9.1928 9.5420 9.5420 k =-0.1633-0.1051 0.0238 ( 7852 PWs) bands (ev): -17.4296 -17.4296 -15.5756 -15.5756 -12.2783 -12.2783 -11.4387 -11.4387 -11.2732 -11.2732 -9.4511 -9.4511 -9.3073 -9.3073 -6.3178 -6.3178 -5.5923 -5.5923 -5.1962 -5.1962 -3.6297 -3.6297 -3.1823 -3.1823 -2.5086 -2.5086 -2.0052 -2.0052 -1.2616 -1.2616 -1.1289 -1.1289 -0.2947 -0.2947 -0.0463 -0.0463 0.0919 0.0919 0.1965 0.1965 0.3359 0.3359 0.5814 0.5814 0.6774 0.6774 2.0765 2.0765 2.4470 2.4470 2.6137 2.6137 2.7088 2.7088 2.7521 2.7521 2.9770 2.9770 3.3587 3.3587 3.5509 3.5509 3.6259 3.6259 3.6720 3.6720 4.9184 4.9184 5.9070 5.9070 6.7116 6.7116 8.8722 8.8722 9.0121 9.0121 9.1783 9.1783 9.5777 9.5777 k =-0.1531-0.0986 0.0223 ( 7852 PWs) bands (ev): -17.4316 -17.4316 -15.5769 -15.5769 -12.2779 -12.2779 -11.4460 -11.4460 -11.2759 -11.2759 -9.4524 -9.4524 -9.3077 -9.3077 -6.3190 -6.3190 -5.5922 -5.5922 -5.1951 -5.1951 -3.6283 -3.6283 -3.1583 -3.1583 -2.5109 -2.5109 -2.0046 -2.0046 -1.2725 -1.2725 -1.1148 -1.1148 -0.2764 -0.2764 -0.0268 -0.0268 0.1030 0.1030 0.1993 0.1993 0.3328 0.3328 0.5770 0.5770 0.6705 0.6705 2.0748 2.0748 2.4567 2.4567 2.6160 2.6160 2.7185 2.7185 2.7550 2.7550 2.9901 2.9901 3.3636 3.3636 3.5618 3.5618 3.6376 3.6376 3.6791 3.6791 4.9167 4.9167 5.9060 5.9060 6.6524 6.6524 8.8380 8.8380 8.9853 8.9853 9.1732 9.1732 9.6026 9.6026 k =-0.1429-0.0920 0.0208 ( 7856 PWs) bands (ev): -17.4335 -17.4335 -15.5781 -15.5781 -12.2775 -12.2775 -11.4530 -11.4530 -11.2785 -11.2785 -9.4536 -9.4536 -9.3081 -9.3081 -6.3202 -6.3202 -5.5920 -5.5920 -5.1940 -5.1940 -3.6269 -3.6269 -3.1352 -3.1352 -2.5131 -2.5131 -2.0040 -2.0040 -1.2840 -1.2840 -1.1012 -1.1012 -0.2594 -0.2594 -0.0073 -0.0073 0.1141 0.1141 0.2027 0.2027 0.3304 0.3304 0.5717 0.5717 0.6639 0.6639 2.0732 2.0732 2.4660 2.4660 2.6175 2.6175 2.7266 2.7266 2.7593 2.7593 3.0049 3.0049 3.3679 3.3679 3.5719 3.5719 3.6496 3.6496 3.6863 3.6863 4.9147 4.9147 5.9047 5.9047 6.5940 6.5940 8.7935 8.7935 8.9624 8.9624 9.1743 9.1743 9.6156 9.6156 k =-0.1327-0.0854 0.0193 ( 7861 PWs) bands (ev): -17.4353 -17.4353 -15.5793 -15.5793 -12.2771 -12.2771 -11.4596 -11.4596 -11.2809 -11.2809 -9.4548 -9.4548 -9.3085 -9.3085 -6.3212 -6.3212 -5.5918 -5.5918 -5.1930 -5.1930 -3.6256 -3.6256 -3.1129 -3.1129 -2.5151 -2.5151 -2.0035 -2.0035 -1.2959 -1.2959 -1.0883 -1.0883 -0.2437 -0.2437 0.0121 0.0121 0.1247 0.1247 0.2066 0.2066 0.3289 0.3289 0.5656 0.5656 0.6576 0.6576 2.0720 2.0720 2.4748 2.4748 2.6183 2.6183 2.7326 2.7326 2.7651 2.7651 3.0214 3.0214 3.3717 3.3717 3.5813 3.5813 3.6616 3.6616 3.6936 3.6936 4.9125 4.9125 5.9032 5.9032 6.5366 6.5366 8.7406 8.7406 8.9451 8.9451 9.1789 9.1789 9.6181 9.6181 k =-0.1224-0.0789 0.0178 ( 7856 PWs) bands (ev): -17.4370 -17.4370 -15.5804 -15.5804 -12.2767 -12.2767 -11.4659 -11.4659 -11.2830 -11.2830 -9.4560 -9.4560 -9.3089 -9.3089 -6.3222 -6.3222 -5.5916 -5.5916 -5.1921 -5.1921 -3.6244 -3.6244 -3.0917 -3.0917 -2.5171 -2.5171 -2.0031 -2.0031 -1.3079 -1.3079 -1.0761 -1.0761 -0.2291 -0.2291 0.0309 0.0309 0.1346 0.1346 0.2113 0.2113 0.3281 0.3281 0.5588 0.5588 0.6519 0.6519 2.0709 2.0709 2.4832 2.4832 2.6187 2.6187 2.7366 2.7366 2.7720 2.7720 3.0396 3.0396 3.3747 3.3747 3.5896 3.5896 3.6734 3.6734 3.7016 3.7016 4.9101 4.9101 5.9015 5.9015 6.4807 6.4807 8.6830 8.6830 8.9322 8.9322 9.1860 9.1860 9.6128 9.6128 k =-0.1122-0.0723 0.0164 ( 7852 PWs) bands (ev): -17.4386 -17.4386 -15.5814 -15.5814 -12.2763 -12.2763 -11.4718 -11.4718 -11.2850 -11.2850 -9.4571 -9.4571 -9.3092 -9.3092 -6.3230 -6.3230 -5.5915 -5.5915 -5.1911 -5.1911 -3.6232 -3.6232 -3.0716 -3.0716 -2.5190 -2.5190 -2.0027 -2.0027 -1.3198 -1.3198 -1.0646 -1.0646 -0.2157 -0.2157 0.0490 0.0490 0.1434 0.1434 0.2168 0.2168 0.3280 0.3280 0.5512 0.5512 0.6467 0.6467 2.0700 2.0700 2.4911 2.4911 2.6186 2.6186 2.7394 2.7394 2.7791 2.7791 3.0592 3.0592 3.3769 3.3769 3.5969 3.5969 3.6840 3.6840 3.7108 3.7108 4.9077 4.9077 5.8996 5.8996 6.4266 6.4266 8.6239 8.6239 8.9223 8.9223 9.1949 9.1949 9.6019 9.6019 k =-0.1020-0.0657 0.0149 ( 7857 PWs) bands (ev): -17.4401 -17.4401 -15.5823 -15.5823 -12.2760 -12.2760 -11.4773 -11.4773 -11.2869 -11.2869 -9.4581 -9.4581 -9.3096 -9.3096 -6.3238 -6.3238 -5.5913 -5.5913 -5.1903 -5.1903 -3.6220 -3.6220 -3.0528 -3.0528 -2.5208 -2.5208 -2.0023 -2.0023 -1.3313 -1.3313 -1.0539 -1.0539 -0.2035 -0.2035 0.0660 0.0660 0.1510 0.1510 0.2231 0.2231 0.3285 0.3285 0.5431 0.5431 0.6421 0.6421 2.0693 2.0693 2.4984 2.4984 2.6183 2.6183 2.7413 2.7413 2.7858 2.7858 3.0799 3.0799 3.3783 3.3783 3.6032 3.6032 3.6929 3.6929 3.7218 3.7218 4.9052 4.9052 5.8977 5.8977 6.3748 6.3748 8.5653 8.5653 8.9142 8.9142 9.2051 9.2051 9.5871 9.5871 k =-0.0918-0.0591 0.0134 ( 7858 PWs) bands (ev): -17.4414 -17.4414 -15.5832 -15.5832 -12.2757 -12.2757 -11.4823 -11.4823 -11.2885 -11.2885 -9.4591 -9.4591 -9.3099 -9.3099 -6.3245 -6.3245 -5.5912 -5.5912 -5.1895 -5.1895 -3.6210 -3.6210 -3.0354 -3.0354 -2.5224 -2.5224 -2.0019 -2.0019 -1.3424 -1.3424 -1.0441 -1.0441 -0.1925 -0.1925 0.0818 0.0818 0.1575 0.1575 0.2301 0.2301 0.3293 0.3293 0.5347 0.5347 0.6381 0.6381 2.0688 2.0688 2.5052 2.5052 2.6177 2.6177 2.7428 2.7428 2.7919 2.7919 3.1015 3.1015 3.3788 3.3788 3.6086 3.6086 3.6999 3.6999 3.7343 3.7343 4.9028 4.9028 5.8957 5.8957 6.3258 6.3258 8.5090 8.5090 8.9074 8.9074 9.2166 9.2166 9.5699 9.5699 k =-0.0816-0.0526 0.0119 ( 7858 PWs) bands (ev): -17.4426 -17.4426 -15.5840 -15.5840 -12.2754 -12.2754 -11.4869 -11.4869 -11.2900 -11.2900 -9.4600 -9.4600 -9.3102 -9.3102 -6.3252 -6.3252 -5.5911 -5.5911 -5.1888 -5.1888 -3.6200 -3.6200 -3.0195 -3.0195 -2.5239 -2.5239 -2.0015 -2.0015 -1.3529 -1.3529 -1.0352 -1.0352 -0.1826 -0.1826 0.0961 0.0961 0.1630 0.1630 0.2378 0.2378 0.3303 0.3303 0.5260 0.5260 0.6347 0.6347 2.0684 2.0684 2.5115 2.5115 2.6169 2.6169 2.7439 2.7439 2.7972 2.7972 3.1235 3.1235 3.3784 3.3784 3.6130 3.6130 3.7055 3.7055 3.7476 3.7476 4.9005 4.9005 5.8938 5.8938 6.2800 6.2800 8.4562 8.4562 8.9016 8.9016 9.2290 9.2290 9.5512 9.5512 k =-0.0714-0.0460 0.0104 ( 7853 PWs) bands (ev): -17.4437 -17.4437 -15.5847 -15.5847 -12.2751 -12.2751 -11.4910 -11.4910 -11.2912 -11.2912 -9.4608 -9.4608 -9.3104 -9.3104 -6.3257 -6.3257 -5.5910 -5.5910 -5.1881 -5.1881 -3.6191 -3.6191 -3.0052 -3.0052 -2.5253 -2.5253 -2.0011 -2.0011 -1.3625 -1.3625 -1.0272 -1.0272 -0.1739 -0.1739 0.1088 0.1088 0.1677 0.1677 0.2460 0.2460 0.3312 0.3312 0.5173 0.5173 0.6319 0.6319 2.0681 2.0681 2.5172 2.5172 2.6159 2.6159 2.7449 2.7449 2.8017 2.8017 3.1453 3.1453 3.3771 3.3771 3.6167 3.6167 3.7100 3.7100 3.7610 3.7610 4.8983 4.8983 5.8919 5.8919 6.2379 6.2379 8.4076 8.4076 8.8964 8.8964 9.2425 9.2425 9.5318 9.5318 k =-0.0612-0.0394 0.0089 ( 7856 PWs) bands (ev): -17.4447 -17.4447 -15.5853 -15.5853 -12.2749 -12.2749 -11.4946 -11.4946 -11.2923 -11.2923 -9.4615 -9.4615 -9.3106 -9.3106 -6.3262 -6.3262 -5.5909 -5.5909 -5.1876 -5.1876 -3.6183 -3.6183 -2.9926 -2.9926 -2.5265 -2.5265 -2.0008 -2.0008 -1.3711 -1.3711 -1.0202 -1.0202 -0.1664 -0.1664 0.1195 0.1195 0.1718 0.1718 0.2545 0.2545 0.3317 0.3317 0.5089 0.5089 0.6298 0.6298 2.0679 2.0679 2.5223 2.5223 2.6149 2.6149 2.7458 2.7458 2.8055 2.8055 3.1666 3.1666 3.3748 3.3748 3.6196 3.6196 3.7138 3.7138 3.7736 3.7736 4.8963 4.8963 5.8902 5.8902 6.2001 6.2001 8.3642 8.3642 8.8918 8.8918 9.2568 9.2568 9.5127 9.5127 k =-0.0510-0.0329 0.0074 ( 7856 PWs) bands (ev): -17.4455 -17.4455 -15.5858 -15.5858 -12.2747 -12.2747 -11.4977 -11.4977 -11.2933 -11.2933 -9.4621 -9.4621 -9.3108 -9.3108 -6.3266 -6.3266 -5.5908 -5.5908 -5.1871 -5.1871 -3.6177 -3.6177 -2.9817 -2.9817 -2.5275 -2.5275 -2.0005 -2.0005 -1.3786 -1.3786 -1.0142 -1.0142 -0.1600 -0.1600 0.1283 0.1283 0.1754 0.1754 0.2633 0.2633 0.3316 0.3316 0.5010 0.5010 0.6281 0.6281 2.0678 2.0678 2.5268 2.5268 2.6139 2.6139 2.7465 2.7465 2.8085 2.8085 3.1866 3.1866 3.3717 3.3717 3.6220 3.6220 3.7168 3.7168 3.7852 3.7852 4.8946 4.8946 5.8887 5.8887 6.1670 6.1670 8.3264 8.3264 8.8877 8.8877 9.2719 9.2719 9.4944 9.4944 k =-0.0408-0.0263 0.0059 ( 7843 PWs) bands (ev): -17.4461 -17.4461 -15.5863 -15.5863 -12.2745 -12.2745 -11.5003 -11.5003 -11.2940 -11.2940 -9.4626 -9.4626 -9.3110 -9.3110 -6.3269 -6.3269 -5.5907 -5.5907 -5.1867 -5.1867 -3.6171 -3.6171 -2.9727 -2.9727 -2.5284 -2.5284 -2.0002 -2.0002 -1.3849 -1.3849 -1.0093 -1.0093 -0.1548 -0.1548 0.1352 0.1352 0.1785 0.1785 0.2720 0.2720 0.3307 0.3307 0.4939 0.4939 0.6269 0.6269 2.0677 2.0677 2.5305 2.5305 2.6129 2.6129 2.7470 2.7470 2.8109 2.8109 3.2050 3.2050 3.3680 3.3680 3.6238 3.6238 3.7193 3.7193 3.7953 3.7953 4.8932 4.8932 5.8874 5.8874 6.1392 6.1392 8.2949 8.2949 8.8842 8.8842 9.2875 9.2875 9.4772 9.4772 k =-0.0306-0.0197 0.0045 ( 7843 PWs) bands (ev): -17.4467 -17.4467 -15.5866 -15.5866 -12.2743 -12.2743 -11.5023 -11.5023 -11.2946 -11.2946 -9.4630 -9.4630 -9.3111 -9.3111 -6.3272 -6.3272 -5.5907 -5.5907 -5.1864 -5.1864 -3.6167 -3.6167 -2.9657 -2.9657 -2.5290 -2.5290 -2.0000 -2.0000 -1.3898 -1.3898 -1.0054 -1.0054 -0.1507 -0.1507 0.1402 0.1402 0.1812 0.1812 0.2804 0.2804 0.3289 0.3289 0.4880 0.4880 0.6261 0.6261 2.0676 2.0676 2.5335 2.5335 2.6120 2.6120 2.7475 2.7475 2.8127 2.8127 3.2209 3.2209 3.3639 3.3639 3.6252 3.6252 3.7212 3.7212 3.8035 3.8035 4.8920 4.8920 5.8863 5.8863 6.1170 6.1170 8.2700 8.2700 8.8814 8.8814 9.3033 9.3033 9.4592 9.4592 k =-0.0204-0.0131 0.0030 ( 7840 PWs) bands (ev): -17.4470 -17.4470 -15.5868 -15.5868 -12.2743 -12.2743 -11.5037 -11.5037 -11.2950 -11.2950 -9.4633 -9.4633 -9.3112 -9.3112 -6.3274 -6.3274 -5.5906 -5.5906 -5.1861 -5.1861 -3.6163 -3.6163 -2.9606 -2.9606 -2.5295 -2.5295 -1.9999 -1.9999 -1.3935 -1.3935 -1.0027 -1.0027 -0.1479 -0.1479 0.1436 0.1436 0.1832 0.1832 0.2879 0.2879 0.3264 0.3264 0.4836 0.4836 0.6256 0.6256 2.0676 2.0676 2.5357 2.5357 2.6113 2.6113 2.7478 2.7478 2.8140 2.8140 3.2335 3.2335 3.3600 3.3600 3.6261 3.6261 3.7226 3.7226 3.8096 3.8096 4.8912 4.8912 5.8855 5.8855 6.1009 6.1009 8.2520 8.2520 8.8793 8.8793 9.3183 9.3183 9.4400 9.4400 k =-0.0102-0.0066 0.0015 ( 7838 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5045 -11.5045 -11.2953 -11.2953 -9.4635 -9.4635 -9.3112 -9.3112 -6.3275 -6.3275 -5.5906 -5.5906 -5.1860 -5.1860 -3.6162 -3.6162 -2.9575 -2.9575 -2.5298 -2.5298 -1.9998 -1.9998 -1.3956 -1.3956 -1.0010 -1.0010 -0.1461 -0.1461 0.1456 0.1456 0.1845 0.1845 0.2936 0.2936 0.3238 0.3238 0.4808 0.4808 0.6253 0.6253 2.0676 2.0676 2.5371 2.5371 2.6109 2.6109 2.7480 2.7480 2.8147 2.8147 3.2417 3.2417 3.3571 3.3571 3.6266 3.6266 3.7234 3.7234 3.8133 3.8133 4.8907 4.8907 5.8851 5.8851 6.0911 6.0911 8.2411 8.2411 8.8780 8.8780 9.3305 9.3305 9.4248 9.4248 k = 0.0000 0.0000 0.0000 ( 7841 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5048 -11.5048 -11.2954 -11.2954 -9.4635 -9.4635 -9.3113 -9.3113 -6.3275 -6.3275 -5.5906 -5.5906 -5.1860 -5.1860 -3.6161 -3.6161 -2.9565 -2.9565 -2.5299 -2.5299 -1.9997 -1.9997 -1.3964 -1.3964 -1.0004 -1.0004 -0.1455 -0.1455 0.1462 0.1462 0.1849 0.1849 0.2958 0.2958 0.3227 0.3227 0.4798 0.4798 0.6252 0.6252 2.0676 2.0676 2.5375 2.5375 2.6108 2.6108 2.7480 2.7480 2.8149 2.8149 3.2445 3.2445 3.3560 3.3560 3.6268 3.6268 3.7237 3.7237 3.8145 3.8145 4.8906 4.8906 5.8849 5.8849 6.0878 6.0878 8.2375 8.2375 8.8775 8.8775 9.3355 9.3355 9.4187 9.4187 k = 0.0000 0.0000 0.0000 ( 7841 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5048 -11.5048 -11.2954 -11.2954 -9.4635 -9.4635 -9.3113 -9.3113 -6.3275 -6.3275 -5.5906 -5.5906 -5.1860 -5.1860 -3.6161 -3.6161 -2.9565 -2.9565 -2.5299 -2.5299 -1.9997 -1.9997 -1.3964 -1.3964 -1.0004 -1.0004 -0.1455 -0.1455 0.1462 0.1462 0.1849 0.1849 0.2958 0.2958 0.3227 0.3227 0.4798 0.4798 0.6252 0.6252 2.0676 2.0676 2.5375 2.5375 2.6108 2.6108 2.7480 2.7480 2.8149 2.8149 3.2445 3.2445 3.3560 3.3560 3.6268 3.6268 3.7237 3.7237 3.8145 3.8145 4.8906 4.8906 5.8849 5.8849 6.0878 6.0878 8.2375 8.2375 8.8775 8.8775 9.3355 9.3355 9.4187 9.4187 k = 0.0000 0.0000 0.0123 ( 7840 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2743 -12.2743 -11.5047 -11.5047 -11.2955 -11.2955 -9.4635 -9.4635 -9.3112 -9.3112 -6.3277 -6.3277 -5.5906 -5.5906 -5.1860 -5.1860 -3.6162 -3.6162 -2.9565 -2.9565 -2.5296 -2.5296 -2.0012 -2.0012 -1.3934 -1.3934 -1.0004 -1.0004 -0.1462 -0.1462 0.1455 0.1455 0.1845 0.1845 0.2961 0.2961 0.3227 0.3227 0.4800 0.4800 0.6252 0.6252 2.0674 2.0674 2.5373 2.5373 2.6110 2.6110 2.7478 2.7478 2.8156 2.8156 3.2446 3.2446 3.3556 3.3556 3.6265 3.6265 3.7231 3.7231 3.8146 3.8146 4.8904 4.8904 5.8850 5.8850 6.0900 6.0900 8.2354 8.2354 8.8775 8.8775 9.3319 9.3319 9.4123 9.4123 k = 0.0000 0.0000 0.0246 ( 7842 PWs) bands (ev): -17.4473 -17.4473 -15.5871 -15.5871 -12.2745 -12.2745 -11.5041 -11.5041 -11.2957 -11.2957 -9.4633 -9.4633 -9.3109 -9.3109 -6.3283 -6.3283 -5.5908 -5.5908 -5.1863 -5.1863 -3.6165 -3.6165 -2.9566 -2.9566 -2.5288 -2.5288 -2.0057 -2.0057 -1.3846 -1.3846 -1.0001 -1.0001 -0.1483 -0.1483 0.1434 0.1434 0.1834 0.1834 0.2968 0.2968 0.3227 0.3227 0.4807 0.4807 0.6252 0.6252 2.0670 2.0670 2.5365 2.5365 2.6119 2.6119 2.7472 2.7472 2.8174 2.8174 3.2446 3.2446 3.3546 3.3546 3.6254 3.6254 3.7214 3.7214 3.8149 3.8149 4.8900 4.8900 5.8851 5.8851 6.0966 6.0966 8.2293 8.2293 8.8773 8.8773 9.3220 9.3220 9.4034 9.4034 k = 0.0000 0.0000 0.0368 ( 7844 PWs) bands (ev): -17.4473 -17.4473 -15.5871 -15.5871 -12.2749 -12.2749 -11.5033 -11.5033 -11.2961 -11.2961 -9.4631 -9.4631 -9.3106 -9.3106 -6.3293 -6.3293 -5.5911 -5.5911 -5.1868 -5.1868 -3.6171 -3.6171 -2.9567 -2.9567 -2.5274 -2.5274 -2.0127 -2.0127 -1.3703 -1.3703 -0.9998 -0.9998 -0.1518 -0.1518 0.1400 0.1400 0.1817 0.1817 0.2978 0.2978 0.3229 0.3229 0.4817 0.4817 0.6251 0.6251 2.0662 2.0662 2.5353 2.5353 2.6133 2.6133 2.7462 2.7462 2.8203 2.8203 3.2447 3.2447 3.3529 3.3529 3.6237 3.6237 3.7186 3.7186 3.8153 3.8153 4.8893 4.8893 5.8854 5.8854 6.1074 6.1074 8.2192 8.2192 8.8766 8.8766 9.3086 9.3086 9.3968 9.3968 k = 0.0000 0.0000 0.0491 ( 7844 PWs) bands (ev): -17.4473 -17.4473 -15.5872 -15.5872 -12.2755 -12.2755 -11.5021 -11.5021 -11.2967 -11.2967 -9.4628 -9.4628 -9.3101 -9.3101 -6.3307 -6.3307 -5.5915 -5.5915 -5.1874 -5.1874 -3.6179 -3.6179 -2.9568 -2.9568 -2.5255 -2.5255 -2.0218 -2.0218 -1.3511 -1.3511 -0.9993 -0.9993 -0.1566 -0.1566 0.1351 0.1351 0.1795 0.1795 0.2989 0.2989 0.3232 0.3232 0.4831 0.4831 0.6251 0.6251 2.0652 2.0652 2.5338 2.5338 2.6150 2.6150 2.7450 2.7450 2.8242 2.8242 3.2448 3.2448 3.3505 3.3505 3.6213 3.6213 3.7147 3.7147 3.8158 3.8158 4.8883 4.8883 5.8859 5.8859 6.1224 6.1224 8.2056 8.2056 8.8750 8.8750 9.2945 9.2945 9.3917 9.3917 k = 0.0000 0.0000 0.0614 ( 7844 PWs) bands (ev): -17.4472 -17.4472 -15.5873 -15.5873 -12.2762 -12.2762 -11.5006 -11.5006 -11.2974 -11.2974 -9.4624 -9.4624 -9.3094 -9.3094 -6.3324 -6.3324 -5.5919 -5.5919 -5.1882 -5.1882 -3.6188 -3.6188 -2.9570 -2.9570 -2.5232 -2.5232 -2.0325 -2.0325 -1.3275 -1.3275 -0.9986 -0.9986 -0.1627 -0.1627 0.1288 0.1288 0.1771 0.1771 0.2999 0.2999 0.3239 0.3239 0.4849 0.4849 0.6250 0.6250 2.0639 2.0639 2.5319 2.5319 2.6171 2.6171 2.7437 2.7437 2.8290 2.8290 3.2450 3.2450 3.3475 3.3475 3.6185 3.6185 3.7099 3.7099 3.8165 3.8165 4.8871 4.8871 5.8864 5.8864 6.1412 6.1412 8.1886 8.1886 8.8717 8.8717 9.2819 9.2819 9.3870 9.3870 k = 0.0000 0.0000 0.0737 ( 7846 PWs) bands (ev): -17.4472 -17.4472 -15.5874 -15.5874 -12.2770 -12.2770 -11.4988 -11.4988 -11.2983 -11.2983 -9.4620 -9.4620 -9.3087 -9.3087 -6.3344 -6.3344 -5.5925 -5.5925 -5.1892 -5.1892 -3.6199 -3.6199 -2.9572 -2.9572 -2.5205 -2.5205 -2.0444 -2.0444 -1.3004 -1.3004 -0.9979 -0.9979 -0.1699 -0.1699 0.1213 0.1213 0.1744 0.1744 0.3006 0.3006 0.3250 0.3250 0.4870 0.4870 0.6248 0.6248 2.0624 2.0624 2.5299 2.5299 2.6193 2.6193 2.7423 2.7423 2.8346 2.8346 3.2453 3.2453 3.3439 3.3439 3.6151 3.6151 3.7042 3.7042 3.8172 3.8172 4.8857 4.8857 5.8871 5.8871 6.1635 6.1635 8.1687 8.1687 8.8662 8.8662 9.2721 9.2721 9.3818 9.3818 k = 0.0000 0.0000 0.0860 ( 7840 PWs) bands (ev): -17.4471 -17.4471 -15.5875 -15.5875 -12.2780 -12.2780 -11.4968 -11.4968 -11.2993 -11.2993 -9.4615 -9.4615 -9.3078 -9.3078 -6.3366 -6.3366 -5.5931 -5.5931 -5.1902 -5.1902 -3.6212 -3.6212 -2.9574 -2.9574 -2.5174 -2.5174 -2.0567 -2.0567 -1.2702 -1.2702 -0.9970 -0.9970 -0.1784 -0.1784 0.1126 0.1126 0.1716 0.1716 0.3010 0.3010 0.3265 0.3265 0.4894 0.4894 0.6246 0.6246 2.0608 2.0608 2.5277 2.5277 2.6216 2.6216 2.7410 2.7410 2.8408 2.8408 3.2457 3.2457 3.3398 3.3398 3.6114 3.6114 3.6977 3.6977 3.8181 3.8181 4.8841 4.8841 5.8879 5.8879 6.1891 6.1891 8.1463 8.1463 8.8582 8.8582 9.2660 9.2660 9.3759 9.3759 k = 0.0000 0.0000 0.0982 ( 7842 PWs) bands (ev): -17.4471 -17.4471 -15.5876 -15.5876 -12.2790 -12.2790 -11.4946 -11.4946 -11.3004 -11.3004 -9.4609 -9.4609 -9.3068 -9.3068 -6.3391 -6.3391 -5.5938 -5.5938 -5.1914 -5.1914 -3.6226 -3.6226 -2.9577 -2.9577 -2.5140 -2.5140 -2.0693 -2.0693 -1.2377 -1.2377 -0.9961 -0.9961 -0.1879 -0.1879 0.1029 0.1029 0.1686 0.1686 0.3011 0.3011 0.3283 0.3283 0.4921 0.4921 0.6243 0.6243 2.0590 2.0590 2.5255 2.5255 2.6239 2.6239 2.7397 2.7397 2.8476 2.8476 3.2462 3.2462 3.3351 3.3351 3.6074 3.6074 3.6905 3.6905 3.8189 3.8189 4.8824 4.8824 5.8888 5.8888 6.2174 6.2174 8.1217 8.1217 8.8476 8.8476 9.2638 9.2638 9.3688 9.3688 k = 0.0000 0.0000 0.1105 ( 7842 PWs) bands (ev): -17.4470 -17.4470 -15.5877 -15.5877 -12.2801 -12.2801 -11.4923 -11.4923 -11.3016 -11.3016 -9.4603 -9.4603 -9.3058 -9.3058 -6.3417 -6.3417 -5.5946 -5.5946 -5.1926 -5.1926 -3.6241 -3.6241 -2.9580 -2.9580 -2.5104 -2.5104 -2.0817 -2.0817 -1.2034 -1.2034 -0.9950 -0.9950 -0.1983 -0.1983 0.0924 0.0924 0.1656 0.1656 0.3010 0.3010 0.3304 0.3304 0.4949 0.4949 0.6239 0.6239 2.0571 2.0571 2.5233 2.5233 2.6260 2.6260 2.7386 2.7386 2.8548 2.8548 3.2468 3.2468 3.3301 3.3301 3.6033 3.6033 3.6828 3.6828 3.8198 3.8198 4.8805 4.8805 5.8898 5.8898 6.2482 6.2482 8.0954 8.0954 8.8344 8.8344 9.2655 9.2655 9.3605 9.3605 k = 0.0000 0.0000 0.1228 ( 7842 PWs) bands (ev): -17.4470 -17.4470 -15.5878 -15.5878 -12.2812 -12.2812 -11.4898 -11.4898 -11.3029 -11.3029 -9.4597 -9.4597 -9.3048 -9.3048 -6.3445 -6.3445 -5.5953 -5.5953 -5.1939 -5.1939 -3.6256 -3.6256 -2.9583 -2.9583 -2.5067 -2.5067 -2.0937 -2.0937 -1.1679 -1.1679 -0.9940 -0.9940 -0.2097 -0.2097 0.0813 0.0813 0.1625 0.1625 0.3007 0.3007 0.3325 0.3325 0.4980 0.4980 0.6234 0.6234 2.0551 2.0551 2.5211 2.5211 2.6280 2.6280 2.7376 2.7376 2.8623 2.8623 3.2475 3.2475 3.3247 3.3247 3.5991 3.5991 3.6746 3.6746 3.8207 3.8207 4.8786 4.8786 5.8908 5.8908 6.2807 6.2807 8.0677 8.0677 8.8191 8.8191 9.2706 9.2706 9.3511 9.3511 k = 0.0000 0.0000 0.1351 ( 7842 PWs) bands (ev): -17.4469 -17.4469 -15.5880 -15.5880 -12.2823 -12.2823 -11.4873 -11.4873 -11.3042 -11.3042 -9.4591 -9.4591 -9.3037 -9.3037 -6.3473 -6.3473 -5.5961 -5.5961 -5.1952 -5.1952 -3.6272 -3.6272 -2.9586 -2.9586 -2.5030 -2.5030 -2.1050 -2.1050 -1.1316 -1.1316 -0.9928 -0.9928 -0.2218 -0.2218 0.0696 0.0696 0.1594 0.1594 0.3004 0.3004 0.3346 0.3346 0.5013 0.5013 0.6228 0.6228 2.0532 2.0532 2.5189 2.5189 2.6299 2.6299 2.7368 2.7368 2.8700 2.8700 3.2483 3.2483 3.3190 3.3190 3.5951 3.5951 3.6662 3.6662 3.8216 3.8216 4.8767 4.8767 5.8919 5.8919 6.3147 6.3147 8.0391 8.0391 8.8023 8.8023 9.2784 9.2784 9.3412 9.3412 k = 0.0000 0.0000 0.1473 ( 7836 PWs) bands (ev): -17.4468 -17.4468 -15.5881 -15.5881 -12.2835 -12.2835 -11.4847 -11.4847 -11.3055 -11.3055 -9.4585 -9.4585 -9.3026 -9.3026 -6.3501 -6.3501 -5.5969 -5.5969 -5.1965 -5.1965 -3.6288 -3.6288 -2.9589 -2.9589 -2.4992 -2.4992 -2.1156 -2.1156 -1.0952 -1.0952 -0.9916 -0.9916 -0.2346 -0.2346 0.0577 0.0577 0.1564 0.1564 0.3000 0.3000 0.3366 0.3366 0.5046 0.5046 0.6221 0.6221 2.0512 2.0512 2.5169 2.5169 2.6315 2.6315 2.7361 2.7361 2.8779 2.8779 3.2493 3.2493 3.3132 3.3132 3.5912 3.5912 3.6576 3.6576 3.8225 3.8225 4.8748 4.8748 5.8930 5.8930 6.3494 6.3494 8.0099 8.0099 8.7845 8.7845 9.2871 9.2871 9.3322 9.3322 k = 0.0000 0.0000 0.1596 ( 7841 PWs) bands (ev): -17.4468 -17.4468 -15.5883 -15.5883 -12.2846 -12.2846 -11.4822 -11.4822 -11.3068 -11.3068 -9.4579 -9.4579 -9.3015 -9.3015 -6.3529 -6.3529 -5.5977 -5.5977 -5.1978 -5.1978 -3.6303 -3.6303 -2.9592 -2.9592 -2.4956 -2.4956 -2.1253 -2.1253 -1.0592 -1.0592 -0.9902 -0.9902 -0.2480 -0.2480 0.0458 0.0458 0.1534 0.1534 0.2998 0.2998 0.3384 0.3384 0.5079 0.5079 0.6212 0.6212 2.0494 2.0494 2.5150 2.5150 2.6329 2.6329 2.7356 2.7356 2.8856 2.8856 3.2505 3.2505 3.3073 3.3073 3.5875 3.5875 3.6490 3.6490 3.8233 3.8233 4.8730 4.8730 5.8941 5.8941 6.3842 6.3842 7.9808 7.9808 8.7665 8.7665 9.2923 9.2923 9.3284 9.3284 k = 0.0000 0.0000 0.1719 ( 7836 PWs) bands (ev): -17.4467 -17.4467 -15.5884 -15.5884 -12.2857 -12.2857 -11.4798 -11.4798 -11.3081 -11.3081 -9.4573 -9.4573 -9.3005 -9.3005 -6.3555 -6.3555 -5.5985 -5.5985 -5.1990 -5.1990 -3.6318 -3.6318 -2.9596 -2.9596 -2.4921 -2.4921 -2.1340 -2.1340 -1.0246 -1.0246 -0.9884 -0.9884 -0.2616 -0.2616 0.0342 0.0342 0.1505 0.1505 0.2996 0.2996 0.3400 0.3400 0.5112 0.5112 0.6203 0.6203 2.0476 2.0476 2.5133 2.5133 2.6340 2.6340 2.7353 2.7353 2.8931 2.8931 3.2517 3.2517 3.3014 3.3014 3.5842 3.5842 3.6405 3.6405 3.8240 3.8240 4.8712 4.8712 5.8951 5.8951 6.4184 6.4184 7.9521 7.9521 8.7487 8.7487 9.2886 9.2886 9.3352 9.3352 k = 0.0000 0.0000 0.1842 ( 7830 PWs) bands (ev): -17.4467 -17.4467 -15.5885 -15.5885 -12.2866 -12.2866 -11.4775 -11.4775 -11.3093 -11.3093 -9.4568 -9.4568 -9.2995 -9.2995 -6.3580 -6.3580 -5.5992 -5.5992 -5.2001 -5.2001 -3.6332 -3.6332 -2.9599 -2.9599 -2.4889 -2.4889 -2.1417 -2.1417 -0.9968 -0.9968 -0.9811 -0.9811 -0.2755 -0.2755 0.0230 0.0230 0.1479 0.1479 0.2995 0.2995 0.3414 0.3414 0.5145 0.5145 0.6193 0.6193 2.0460 2.0460 2.5117 2.5117 2.6350 2.6350 2.7351 2.7351 2.9003 2.9003 3.2531 3.2531 3.2957 3.2957 3.5814 3.5814 3.6323 3.6323 3.8247 3.8247 4.8696 4.8696 5.8961 5.8961 6.4514 6.4514 7.9245 7.9245 8.7318 8.7318 9.2793 9.2793 9.3492 9.3492 k = 0.0000 0.0000 0.1965 ( 7834 PWs) bands (ev): -17.4466 -17.4466 -15.5886 -15.5886 -12.2876 -12.2876 -11.4754 -11.4754 -11.3104 -11.3104 -9.4563 -9.4563 -9.2986 -9.2986 -6.3602 -6.3602 -5.5998 -5.5998 -5.2012 -5.2012 -3.6344 -3.6344 -2.9601 -2.9601 -2.4860 -2.4860 -2.1483 -2.1483 -0.9902 -0.9902 -0.9548 -0.9548 -0.2891 -0.2891 0.0126 0.0126 0.1455 0.1455 0.2994 0.2994 0.3426 0.3426 0.5175 0.5175 0.6183 0.6183 2.0445 2.0445 2.5103 2.5103 2.6358 2.6358 2.7350 2.7350 2.9069 2.9069 3.2545 3.2545 3.2902 3.2902 3.5790 3.5790 3.6246 3.6246 3.8254 3.8254 4.8681 4.8681 5.8970 5.8970 6.4824 6.4824 7.8985 7.8985 8.7162 8.7162 9.2686 9.2686 9.3664 9.3664 k = 0.0000 0.0000 0.2087 ( 7839 PWs) bands (ev): -17.4466 -17.4466 -15.5887 -15.5887 -12.2883 -12.2883 -11.4735 -11.4735 -11.3114 -11.3114 -9.4559 -9.4559 -9.2979 -9.2979 -6.3622 -6.3622 -5.6004 -5.6004 -5.2021 -5.2021 -3.6356 -3.6356 -2.9604 -2.9604 -2.4834 -2.4834 -2.1540 -2.1540 -0.9886 -0.9886 -0.9263 -0.9263 -0.3023 -0.3023 0.0033 0.0033 0.1434 0.1434 0.2994 0.2994 0.3436 0.3436 0.5203 0.5203 0.6173 0.6173 2.0432 2.0432 2.5091 2.5091 2.6364 2.6364 2.7349 2.7349 2.9129 2.9129 3.2560 3.2560 3.2850 3.2850 3.5772 3.5772 3.6174 3.6174 3.8259 3.8259 4.8668 4.8668 5.8978 5.8978 6.5105 6.5105 7.8748 7.8748 8.7023 8.7023 9.2583 9.2583 9.3849 9.3849 k = 0.0000 0.0000 0.2210 ( 7842 PWs) bands (ev): -17.4465 -17.4465 -15.5888 -15.5888 -12.2890 -12.2890 -11.4719 -11.4719 -11.3123 -11.3123 -9.4555 -9.4555 -9.2972 -9.2972 -6.3639 -6.3639 -5.6009 -5.6009 -5.2029 -5.2029 -3.6365 -3.6365 -2.9606 -2.9606 -2.4812 -2.4812 -2.1586 -2.1586 -0.9877 -0.9877 -0.9008 -0.9008 -0.3143 -0.3143 -0.0048 -0.0048 0.1417 0.1417 0.2995 0.2995 0.3443 0.3443 0.5228 0.5228 0.6164 0.6164 2.0421 2.0421 2.5081 2.5081 2.6368 2.6368 2.7349 2.7349 2.9180 2.9180 3.2576 3.2576 3.2803 3.2803 3.5760 3.5760 3.6111 3.6111 3.8264 3.8264 4.8657 4.8657 5.8985 5.8985 6.5349 6.5349 7.8542 7.8542 8.6904 8.6904 9.2492 9.2492 9.4041 9.4041 k = 0.0000 0.0000 0.2333 ( 7833 PWs) bands (ev): -17.4465 -17.4465 -15.5889 -15.5889 -12.2895 -12.2895 -11.4706 -11.4706 -11.3130 -11.3130 -9.4552 -9.4552 -9.2967 -9.2967 -6.3652 -6.3652 -5.6012 -5.6012 -5.2035 -5.2035 -3.6372 -3.6372 -2.9608 -2.9608 -2.4795 -2.4795 -2.1621 -2.1621 -0.9870 -0.9870 -0.8796 -0.8796 -0.3247 -0.3247 -0.0113 -0.0113 0.1403 0.1403 0.2996 0.2996 0.3449 0.3449 0.5248 0.5248 0.6155 0.6155 2.0413 2.0413 2.5073 2.5073 2.6372 2.6372 2.7349 2.7349 2.9222 2.9222 3.2593 3.2593 3.2761 3.2761 3.5753 3.5753 3.6057 3.6057 3.8268 3.8268 4.8648 4.8648 5.8991 5.8991 6.5549 6.5549 7.8372 7.8372 8.6809 8.6809 9.2418 9.2418 9.4231 9.4231 k = 0.0000 0.0000 0.2456 ( 7833 PWs) bands (ev): -17.4465 -17.4465 -15.5889 -15.5889 -12.2899 -12.2899 -11.4697 -11.4697 -11.3135 -11.3135 -9.4550 -9.4550 -9.2963 -9.2963 -6.3662 -6.3662 -5.6015 -5.6015 -5.2039 -5.2039 -3.6378 -3.6378 -2.9609 -2.9609 -2.4782 -2.4782 -2.1647 -2.1647 -0.9866 -0.9866 -0.8636 -0.8636 -0.3329 -0.3329 -0.0161 -0.0161 0.1392 0.1392 0.2996 0.2996 0.3453 0.3453 0.5263 0.5263 0.6149 0.6149 2.0407 2.0407 2.5068 2.5068 2.6374 2.6374 2.7350 2.7350 2.9253 2.9253 3.2611 3.2611 3.2725 3.2725 3.5750 3.5750 3.6015 3.6015 3.8270 3.8270 4.8642 4.8642 5.8995 5.8995 6.5698 6.5698 7.8246 7.8246 8.6740 8.6740 9.2362 9.2362 9.4409 9.4409 k = 0.0000 0.0000 0.2579 ( 7833 PWs) bands (ev): -17.4465 -17.4465 -15.5889 -15.5889 -12.2902 -12.2902 -11.4691 -11.4691 -11.3138 -11.3138 -9.4549 -9.4549 -9.2961 -9.2961 -6.3668 -6.3668 -5.6017 -5.6017 -5.2042 -5.2042 -3.6381 -3.6381 -2.9610 -2.9610 -2.4774 -2.4774 -2.1662 -2.1662 -0.9863 -0.9863 -0.8536 -0.8536 -0.3380 -0.3380 -0.0191 -0.0191 0.1386 0.1386 0.2997 0.2997 0.3455 0.3455 0.5272 0.5272 0.6145 0.6145 2.0403 2.0403 2.5064 2.5064 2.6375 2.6375 2.7350 2.7350 2.9272 2.9272 3.2629 3.2629 3.2696 3.2696 3.5750 3.5750 3.5988 3.5988 3.8272 3.8272 4.8638 4.8638 5.8997 5.8997 6.5790 6.5790 7.8168 7.8168 8.6697 8.6697 9.2329 9.2329 9.4550 9.4550 k = 0.0000 0.0000 0.2701 ( 7826 PWs) bands (ev): -17.4464 -17.4464 -15.5889 -15.5889 -12.2902 -12.2902 -11.4689 -11.4689 -11.3139 -11.3139 -9.4549 -9.4549 -9.2960 -9.2960 -6.3670 -6.3670 -5.6017 -5.6017 -5.2043 -5.2043 -3.6382 -3.6382 -2.9610 -2.9610 -2.4772 -2.4772 -2.1667 -2.1667 -0.9862 -0.9862 -0.8502 -0.8502 -0.3398 -0.3398 -0.0201 -0.0201 0.1384 0.1384 0.2997 0.2997 0.3456 0.3456 0.5275 0.5275 0.6144 0.6144 2.0402 2.0402 2.5063 2.5063 2.6376 2.6376 2.7350 2.7350 2.9278 2.9278 3.2640 3.2640 3.2682 3.2682 3.5750 3.5750 3.5979 3.5979 3.8272 3.8272 4.8637 4.8637 5.8998 5.8998 6.5821 6.5821 7.8141 7.8141 8.6683 8.6683 9.2317 9.2317 9.4609 9.4609 k = 0.0000-0.2824 0.1740 ( 7842 PWs) bands (ev): -17.4454 -17.4454 -15.5889 -15.5889 -12.3097 -12.3097 -11.4903 -11.4903 -11.2835 -11.2835 -9.4394 -9.4394 -9.2825 -9.2825 -6.3351 -6.3351 -5.5967 -5.5967 -5.2921 -5.2921 -3.6787 -3.6787 -2.9556 -2.9556 -2.4196 -2.4196 -1.9850 -1.9850 -1.2150 -1.2150 -0.9889 -0.9889 -0.1922 -0.1922 0.0283 0.0283 0.0970 0.0970 0.2794 0.2794 0.3033 0.3033 0.4916 0.4916 0.7678 0.7678 2.0701 2.0701 2.5554 2.5554 2.5931 2.5931 2.7619 2.7619 2.7901 2.7901 3.1383 3.1383 3.3605 3.3605 3.5663 3.5663 3.7123 3.7123 3.7560 3.7560 5.0418 5.0418 5.8180 5.8180 6.7254 6.7254 7.6242 7.6242 8.7731 8.7731 9.2603 9.2603 9.4768 9.4768 k = 0.0000-0.2719 0.1676 ( 7835 PWs) bands (ev): -17.4454 -17.4454 -15.5888 -15.5888 -12.3096 -12.3096 -11.4901 -11.4901 -11.2838 -11.2838 -9.4394 -9.4394 -9.2826 -9.2826 -6.3351 -6.3351 -5.5967 -5.5967 -5.2917 -5.2917 -3.6786 -3.6786 -2.9556 -2.9556 -2.4200 -2.4200 -1.9851 -1.9851 -1.2149 -1.2149 -0.9890 -0.9890 -0.1937 -0.1937 0.0284 0.0284 0.0981 0.0981 0.2778 0.2778 0.3056 0.3056 0.4915 0.4915 0.7672 0.7672 2.0701 2.0701 2.5553 2.5553 2.5932 2.5932 2.7618 2.7618 2.7902 2.7902 3.1387 3.1387 3.3604 3.3604 3.5665 3.5665 3.7123 3.7123 3.7564 3.7564 5.0410 5.0410 5.8183 5.8183 6.7235 6.7235 7.6262 7.6262 8.7722 8.7722 9.2622 9.2622 9.4781 9.4781 k = 0.0000-0.2615 0.1611 ( 7837 PWs) bands (ev): -17.4454 -17.4454 -15.5888 -15.5888 -12.3093 -12.3093 -11.4894 -11.4894 -11.2847 -11.2847 -9.4396 -9.4396 -9.2829 -9.2829 -6.3350 -6.3350 -5.5966 -5.5966 -5.2906 -5.2906 -3.6782 -3.6782 -2.9557 -2.9557 -2.4211 -2.4211 -1.9851 -1.9851 -1.2149 -1.2149 -0.9891 -0.9891 -0.1979 -0.1979 0.0290 0.0290 0.1014 0.1014 0.2742 0.2742 0.3113 0.3113 0.4911 0.4911 0.7655 0.7655 2.0700 2.0700 2.5550 2.5550 2.5935 2.5935 2.7615 2.7615 2.7906 2.7906 3.1400 3.1400 3.3602 3.3602 3.5671 3.5671 3.7122 3.7122 3.7576 3.7576 5.0384 5.0384 5.8189 5.8189 6.7177 6.7177 7.6323 7.6323 8.7697 8.7697 9.2675 9.2675 9.4820 9.4820 k = 0.0000-0.2510 0.1547 ( 7834 PWs) bands (ev): -17.4455 -17.4455 -15.5888 -15.5888 -12.3089 -12.3089 -11.4883 -11.4883 -11.2863 -11.2863 -9.4398 -9.4398 -9.2834 -9.2834 -6.3348 -6.3348 -5.5966 -5.5966 -5.2889 -5.2889 -3.6776 -3.6776 -2.9558 -2.9558 -2.4231 -2.4231 -1.9852 -1.9852 -1.2148 -1.2148 -0.9893 -0.9893 -0.2044 -0.2044 0.0300 0.0300 0.1064 0.1064 0.2704 0.2704 0.3186 0.3186 0.4904 0.4904 0.7627 0.7627 2.0699 2.0699 2.5545 2.5545 2.5940 2.5940 2.7609 2.7609 2.7912 2.7912 3.1420 3.1420 3.3599 3.3599 3.5680 3.5680 3.7120 3.7120 3.7595 3.7595 5.0343 5.0343 5.8201 5.8201 6.7080 6.7080 7.6424 7.6424 8.7659 8.7659 9.2750 9.2750 9.4890 9.4890 k = 0.0000-0.2406 0.1482 ( 7839 PWs) bands (ev): -17.4455 -17.4455 -15.5888 -15.5888 -12.3083 -12.3083 -11.4868 -11.4868 -11.2883 -11.2883 -9.4402 -9.4402 -9.2841 -9.2841 -6.3346 -6.3346 -5.5965 -5.5965 -5.2864 -5.2864 -3.6768 -3.6768 -2.9560 -2.9560 -2.4257 -2.4257 -1.9853 -1.9853 -1.2150 -1.2150 -0.9895 -0.9895 -0.2127 -0.2127 0.0317 0.0317 0.1125 0.1125 0.2670 0.2670 0.3267 0.3267 0.4895 0.4895 0.7589 0.7589 2.0698 2.0698 2.5537 2.5537 2.5947 2.5947 2.7602 2.7602 2.7920 2.7920 3.1447 3.1447 3.3596 3.3596 3.5692 3.5692 3.7119 3.7119 3.7619 3.7619 5.0287 5.0287 5.8216 5.8216 6.6945 6.6945 7.6565 7.6565 8.7615 8.7615 9.2835 9.2835 9.4995 9.4995 k = 0.0000-0.2301 0.1418 ( 7840 PWs) bands (ev): -17.4456 -17.4456 -15.5887 -15.5887 -12.3075 -12.3075 -11.4850 -11.4850 -11.2908 -11.2908 -9.4406 -9.4406 -9.2850 -9.2850 -6.3343 -6.3343 -5.5964 -5.5964 -5.2833 -5.2833 -3.6757 -3.6757 -2.9562 -2.9562 -2.4291 -2.4291 -1.9854 -1.9854 -1.2155 -1.2155 -0.9899 -0.9899 -0.2220 -0.2220 0.0340 0.0340 0.1191 0.1191 0.2643 0.2643 0.3350 0.3350 0.4885 0.4885 0.7540 0.7540 2.0697 2.0697 2.5529 2.5529 2.5954 2.5954 2.7594 2.7594 2.7930 2.7930 3.1481 3.1481 3.3591 3.3591 3.5708 3.5708 3.7120 3.7120 3.7649 3.7649 5.0217 5.0217 5.8236 5.8236 6.6773 6.6773 7.6745 7.6745 8.7570 8.7570 9.2915 9.2915 9.5139 9.5139 k = 0.0000-0.2196 0.1354 ( 7841 PWs) bands (ev): -17.4456 -17.4456 -15.5886 -15.5886 -12.3065 -12.3065 -11.4830 -11.4830 -11.2936 -11.2936 -9.4412 -9.4412 -9.2860 -9.2860 -6.3340 -6.3340 -5.5963 -5.5963 -5.2797 -5.2797 -3.6744 -3.6744 -2.9564 -2.9564 -2.4331 -2.4331 -1.9856 -1.9856 -1.2166 -1.2166 -0.9903 -0.9903 -0.2315 -0.2315 0.0371 0.0371 0.1258 0.1258 0.2626 0.2626 0.3432 0.3432 0.4876 0.4876 0.7482 0.7482 2.0696 2.0696 2.5519 2.5519 2.5963 2.5963 2.7585 2.7585 2.7941 2.7941 3.1522 3.1522 3.3586 3.3586 3.5726 3.5726 3.7122 3.7122 3.7683 3.7683 5.0136 5.0136 5.8259 5.8259 6.6565 6.6565 7.6961 7.6961 8.7531 8.7531 9.2978 9.2978 9.5316 9.5316 k = 0.0000-0.2092 0.1289 ( 7842 PWs) bands (ev): -17.4457 -17.4457 -15.5886 -15.5886 -12.3053 -12.3053 -11.4810 -11.4810 -11.2967 -11.2967 -9.4419 -9.4419 -9.2872 -9.2872 -6.3336 -6.3336 -5.5962 -5.5962 -5.2754 -5.2754 -3.6728 -3.6728 -2.9566 -2.9566 -2.4376 -2.4376 -1.9859 -1.9859 -1.2185 -1.2185 -0.9907 -0.9907 -0.2407 -0.2407 0.0408 0.0408 0.1323 0.1323 0.2617 0.2617 0.3509 0.3509 0.4869 0.4869 0.7415 0.7415 2.0694 2.0694 2.5509 2.5509 2.5973 2.5973 2.7575 2.7575 2.7954 2.7954 3.1568 3.1568 3.3580 3.3580 3.5748 3.5748 3.7126 3.7126 3.7719 3.7719 5.0046 5.0046 5.8285 5.8285 6.6323 6.6323 7.7213 7.7213 8.7502 8.7502 9.3019 9.3019 9.5514 9.5514 k = 0.0000-0.1987 0.1225 ( 7844 PWs) bands (ev): -17.4458 -17.4458 -15.5885 -15.5885 -12.3040 -12.3040 -11.4789 -11.4789 -11.2999 -11.2999 -9.4427 -9.4427 -9.2885 -9.2885 -6.3332 -6.3332 -5.5960 -5.5960 -5.2707 -5.2707 -3.6708 -3.6708 -2.9569 -2.9569 -2.4427 -2.4427 -1.9863 -1.9863 -1.2215 -1.2215 -0.9912 -0.9912 -0.2488 -0.2488 0.0451 0.0451 0.1384 0.1384 0.2618 0.2618 0.3577 0.3577 0.4865 0.4865 0.7341 0.7341 2.0692 2.0692 2.5498 2.5498 2.5984 2.5984 2.7565 2.7565 2.7967 2.7967 3.1619 3.1619 3.3575 3.3575 3.5771 3.5771 3.7131 3.7131 3.7757 3.7757 4.9948 4.9948 5.8315 5.8315 6.6051 6.6051 7.7495 7.7495 8.7487 8.7487 9.3040 9.3040 9.5715 9.5715 k = 0.0000-0.1883 0.1160 ( 7848 PWs) bands (ev): -17.4459 -17.4459 -15.5884 -15.5884 -12.3026 -12.3026 -11.4770 -11.4770 -11.3031 -11.3031 -9.4436 -9.4436 -9.2899 -9.2899 -6.3327 -6.3327 -5.5958 -5.5958 -5.2655 -5.2655 -3.6686 -3.6686 -2.9571 -2.9571 -2.4482 -2.4482 -1.9867 -1.9867 -1.2257 -1.2257 -0.9918 -0.9918 -0.2553 -0.2553 0.0499 0.0499 0.1438 0.1438 0.2627 0.2627 0.3633 0.3633 0.4866 0.4866 0.7260 0.7260 2.0690 2.0690 2.5487 2.5487 2.5994 2.5994 2.7556 2.7556 2.7981 2.7981 3.1674 3.1674 3.3569 3.3569 3.5796 3.5796 3.7139 3.7139 3.7796 3.7796 4.9846 4.9846 5.8347 5.8347 6.5751 6.5751 7.7805 7.7805 8.7488 8.7488 9.3043 9.3043 9.5892 9.5892 k = 0.0000-0.1778 0.1096 ( 7849 PWs) bands (ev): -17.4460 -17.4460 -15.5883 -15.5883 -12.3009 -12.3009 -11.4753 -11.4753 -11.3060 -11.3060 -9.4446 -9.4446 -9.2915 -9.2915 -6.3323 -6.3323 -5.5955 -5.5955 -5.2600 -5.2600 -3.6660 -3.6660 -2.9573 -2.9573 -2.4540 -2.4540 -1.9873 -1.9873 -1.2313 -1.2313 -0.9924 -0.9924 -0.2599 -0.2599 0.0551 0.0551 0.1487 0.1487 0.2643 0.2643 0.3675 0.3675 0.4873 0.4873 0.7174 0.7174 2.0688 2.0688 2.5476 2.5476 2.6005 2.6005 2.7546 2.7546 2.7995 2.7995 3.1732 3.1732 3.3563 3.3563 3.5824 3.5824 3.7148 3.7148 3.7835 3.7835 4.9742 4.9742 5.8382 5.8382 6.5427 6.5427 7.8136 7.8136 8.7508 8.7508 9.3033 9.3033 9.6025 9.6025 k = 0.0000-0.1673 0.1031 ( 7850 PWs) bands (ev): -17.4461 -17.4461 -15.5882 -15.5882 -12.2992 -12.2992 -11.4742 -11.4742 -11.3086 -11.3086 -9.4458 -9.4458 -9.2931 -9.2931 -6.3318 -6.3318 -5.5953 -5.5953 -5.2542 -5.2542 -3.6632 -3.6632 -2.9575 -2.9575 -2.4601 -2.4601 -1.9879 -1.9879 -1.2383 -1.2383 -0.9930 -0.9930 -0.2622 -0.2622 0.0606 0.0606 0.1531 0.1531 0.2666 0.2666 0.3700 0.3700 0.4886 0.4886 0.7084 0.7084 2.0687 2.0687 2.5464 2.5464 2.6015 2.6015 2.7537 2.7537 2.8009 2.8009 3.1791 3.1791 3.3558 3.3558 3.5854 3.5854 3.7158 3.7158 3.7874 3.7874 4.9639 4.9639 5.8418 5.8418 6.5084 6.5084 7.8485 7.8485 8.7547 8.7547 9.3016 9.3016 9.6097 9.6097 k = 0.0000-0.1569 0.0967 ( 7854 PWs) bands (ev): -17.4462 -17.4462 -15.5881 -15.5881 -12.2973 -12.2973 -11.4736 -11.4736 -11.3106 -11.3106 -9.4470 -9.4470 -9.2947 -9.2947 -6.3314 -6.3314 -5.5949 -5.5949 -5.2482 -5.2482 -3.6601 -3.6601 -2.9576 -2.9576 -2.4664 -2.4664 -1.9886 -1.9886 -1.2469 -1.2469 -0.9937 -0.9937 -0.2621 -0.2621 0.0665 0.0665 0.1569 0.1569 0.2694 0.2694 0.3710 0.3710 0.4905 0.4905 0.6992 0.6992 2.0685 2.0685 2.5454 2.5454 2.6026 2.6026 2.7529 2.7529 2.8024 2.8024 3.1853 3.1853 3.3554 3.3554 3.5885 3.5885 3.7168 3.7168 3.7912 3.7912 4.9538 4.9538 5.8455 5.8455 6.4727 6.4727 7.8845 7.8845 8.7603 8.7603 9.2997 9.2997 9.6106 9.6106 k = 0.0000-0.1464 0.0902 ( 7851 PWs) bands (ev): -17.4463 -17.4463 -15.5880 -15.5880 -12.2953 -12.2953 -11.4736 -11.4736 -11.3120 -11.3120 -9.4483 -9.4483 -9.2964 -9.2964 -6.3309 -6.3309 -5.5946 -5.5946 -5.2421 -5.2421 -3.6567 -3.6567 -2.9577 -2.9577 -2.4728 -2.4728 -1.9894 -1.9894 -1.2569 -1.2569 -0.9943 -0.9943 -0.2596 -0.2596 0.0726 0.0726 0.1604 0.1604 0.2726 0.2726 0.3703 0.3703 0.4927 0.4927 0.6900 0.6900 2.0684 2.0684 2.5444 2.5444 2.6035 2.6035 2.7521 2.7521 2.8038 2.8038 3.1915 3.1915 3.3550 3.3550 3.5918 3.5918 3.7178 3.7178 3.7948 3.7948 4.9441 4.9441 5.8493 5.8493 6.4360 6.4360 7.9210 7.9210 8.7677 8.7677 9.2977 9.2977 9.6056 9.6056 k = 0.0000-0.1360 0.0838 ( 7851 PWs) bands (ev): -17.4464 -17.4464 -15.5879 -15.5879 -12.2933 -12.2933 -11.4744 -11.4744 -11.3128 -11.3128 -9.4497 -9.4497 -9.2980 -9.2980 -6.3305 -6.3305 -5.5943 -5.5943 -5.2359 -5.2359 -3.6531 -3.6531 -2.9578 -2.9578 -2.4792 -2.4792 -1.9903 -1.9903 -1.2682 -1.2682 -0.9950 -0.9950 -0.2548 -0.2548 0.0788 0.0788 0.1635 0.1635 0.2760 0.2760 0.3683 0.3683 0.4949 0.4949 0.6808 0.6808 2.0682 2.0682 2.5434 2.5434 2.6045 2.6045 2.7514 2.7514 2.8052 2.8052 3.1976 3.1976 3.3547 3.3547 3.5952 3.5952 3.7188 3.7188 3.7981 3.7981 4.9351 4.9351 5.8531 5.8531 6.3989 6.3989 7.9574 7.9574 8.7765 8.7765 9.2962 9.2962 9.5961 9.5961 k = 0.0000-0.1255 0.0773 ( 7853 PWs) bands (ev): -17.4466 -17.4466 -15.5878 -15.5878 -12.2912 -12.2912 -11.4759 -11.4759 -11.3128 -11.3128 -9.4512 -9.4512 -9.2997 -9.2997 -6.3300 -6.3300 -5.5939 -5.5939 -5.2298 -5.2298 -3.6493 -3.6493 -2.9578 -2.9578 -2.4855 -2.4855 -1.9912 -1.9912 -1.2806 -1.2806 -0.9957 -0.9957 -0.2479 -0.2479 0.0852 0.0852 0.1662 0.1662 0.2795 0.2795 0.3652 0.3652 0.4968 0.4968 0.6720 0.6720 2.0681 2.0681 2.5425 2.5425 2.6054 2.6054 2.7508 2.7508 2.8065 2.8065 3.2036 3.2036 3.3545 3.3545 3.5987 3.5987 3.7198 3.7198 3.8011 3.8011 4.9268 4.9268 5.8569 5.8569 6.3618 6.3618 7.9932 7.9932 8.7865 8.7865 9.2953 9.2953 9.5830 9.5830 k = 0.0000-0.1150 0.0709 ( 7856 PWs) bands (ev): -17.4467 -17.4467 -15.5877 -15.5877 -12.2891 -12.2891 -11.4780 -11.4780 -11.3122 -11.3122 -9.4527 -9.4527 -9.3013 -9.3013 -6.3296 -6.3296 -5.5935 -5.5935 -5.2238 -5.2238 -3.6454 -3.6454 -2.9578 -2.9578 -2.4916 -2.4916 -1.9922 -1.9922 -1.2938 -1.2938 -0.9964 -0.9964 -0.2392 -0.2392 0.0917 0.0917 0.1688 0.1688 0.2830 0.2830 0.3612 0.3612 0.4982 0.4982 0.6636 0.6636 2.0680 2.0680 2.5416 2.5416 2.6062 2.6062 2.7502 2.7502 2.8077 2.8077 3.2094 3.2094 3.3544 3.3544 3.6022 3.6022 3.7206 3.7206 3.8038 3.8038 4.9194 4.9194 5.8606 5.8606 6.3253 6.3253 8.0279 8.0279 8.7974 8.7974 9.2953 9.2953 9.5675 9.5675 k = 0.0000-0.1046 0.0645 ( 7854 PWs) bands (ev): -17.4468 -17.4468 -15.5876 -15.5876 -12.2870 -12.2870 -11.4807 -11.4807 -11.3110 -11.3110 -9.4542 -9.4542 -9.3029 -9.3029 -6.3293 -6.3293 -5.5931 -5.5931 -5.2180 -5.2180 -3.6414 -3.6414 -2.9577 -2.9577 -2.4976 -2.4976 -1.9932 -1.9932 -1.3074 -1.3074 -0.9970 -0.9970 -0.2290 -0.2290 0.0983 0.0983 0.1711 0.1711 0.2865 0.2865 0.3565 0.3565 0.4988 0.4988 0.6559 0.6559 2.0679 2.0679 2.5409 2.5409 2.6070 2.6070 2.7498 2.7498 2.8089 2.8089 3.2150 3.2150 3.3544 3.3544 3.6057 3.6057 3.7213 3.7213 3.8062 3.8062 4.9129 4.9129 5.8642 5.8642 6.2897 6.2897 8.0610 8.0610 8.8087 8.8087 9.2962 9.2962 9.5503 9.5503 k = 0.0000-0.0941 0.0580 ( 7852 PWs) bands (ev): -17.4469 -17.4469 -15.5875 -15.5875 -12.2849 -12.2849 -11.4838 -11.4838 -11.3093 -11.3093 -9.4556 -9.4556 -9.3043 -9.3043 -6.3289 -6.3289 -5.5927 -5.5927 -5.2125 -5.2125 -3.6375 -3.6375 -2.9576 -2.9576 -2.5032 -2.5032 -1.9942 -1.9942 -1.3211 -1.3211 -0.9976 -0.9976 -0.2179 -0.2179 0.1049 0.1049 0.1732 0.1732 0.2897 0.2897 0.3514 0.3514 0.4986 0.4986 0.6491 0.6491 2.0678 2.0678 2.5402 2.5402 2.6077 2.6077 2.7494 2.7494 2.8100 2.8100 3.2202 3.2202 3.3544 3.3544 3.6091 3.6091 3.7219 3.7219 3.8082 3.8082 4.9074 4.9074 5.8676 5.8676 6.2557 6.2557 8.0921 8.0921 8.8200 8.8200 9.2982 9.2982 9.5323 9.5323 k = 0.0000-0.0837 0.0516 ( 7850 PWs) bands (ev): -17.4470 -17.4470 -15.5874 -15.5874 -12.2829 -12.2829 -11.4872 -11.4872 -11.3073 -11.3073 -9.4571 -9.4571 -9.3057 -9.3057 -6.3286 -6.3286 -5.5923 -5.5923 -5.2073 -5.2073 -3.6336 -3.6336 -2.9575 -2.9575 -2.5084 -2.5084 -1.9952 -1.9952 -1.3346 -1.3346 -0.9982 -0.9982 -0.2062 -0.2062 0.1116 0.1116 0.1750 0.1750 0.2927 0.2927 0.3461 0.3461 0.4974 0.4974 0.6432 0.6432 2.0677 2.0677 2.5397 2.5397 2.6083 2.6083 2.7490 2.7490 2.8110 2.8110 3.2250 3.2250 3.3546 3.3546 3.6124 3.6124 3.7224 3.7224 3.8099 3.8099 4.9029 4.9029 5.8709 5.8709 6.2237 6.2237 8.1208 8.1208 8.8310 8.8310 9.3012 9.3012 9.5138 9.5138 k = 0.0000-0.0732 0.0451 ( 7854 PWs) bands (ev): -17.4470 -17.4470 -15.5873 -15.5873 -12.2811 -12.2811 -11.4906 -11.4906 -11.3051 -11.3051 -9.4584 -9.4584 -9.3069 -9.3069 -6.3284 -6.3284 -5.5920 -5.5920 -5.2026 -5.2026 -3.6300 -3.6300 -2.9574 -2.9574 -2.5132 -2.5132 -1.9962 -1.9962 -1.3475 -1.3475 -0.9987 -0.9987 -0.1944 -0.1944 0.1181 0.1181 0.1767 0.1767 0.2952 0.2952 0.3407 0.3407 0.4954 0.4954 0.6382 0.6382 2.0677 2.0677 2.5391 2.5391 2.6089 2.6089 2.7488 2.7488 2.8119 2.8119 3.2294 3.2294 3.3547 3.3547 3.6154 3.6154 3.7228 3.7228 3.8112 3.8112 4.8992 4.8992 5.8739 5.8739 6.1942 6.1942 8.1470 8.1470 8.8413 8.8413 9.3051 9.3051 9.4954 9.4954 k = 0.0000-0.0628 0.0387 ( 7860 PWs) bands (ev): -17.4471 -17.4471 -15.5872 -15.5872 -12.2794 -12.2794 -11.4939 -11.4939 -11.3030 -11.3030 -9.4597 -9.4597 -9.3080 -9.3080 -6.3281 -6.3281 -5.5916 -5.5916 -5.1984 -5.1984 -3.6266 -3.6266 -2.9572 -2.9572 -2.5175 -2.5175 -1.9970 -1.9970 -1.3594 -1.3594 -0.9992 -0.9992 -0.1830 -0.1830 0.1244 0.1244 0.1783 0.1783 0.2972 0.2972 0.3356 0.3356 0.4928 0.4928 0.6342 0.6342 2.0676 2.0676 2.5387 2.5387 2.6094 2.6094 2.7485 2.7485 2.8127 2.8127 3.2333 3.2333 3.3550 3.3550 3.6183 3.6183 3.7231 3.7231 3.8123 3.8123 4.8964 4.8964 5.8766 5.8766 6.1675 6.1675 8.1702 8.1702 8.8506 8.8506 9.3099 9.3099 9.4777 9.4777 k = 0.0000-0.0523 0.0322 ( 7857 PWs) bands (ev): -17.4472 -17.4472 -15.5872 -15.5872 -12.2779 -12.2779 -11.4969 -11.4969 -11.3009 -11.3009 -9.4608 -9.4608 -9.3090 -9.3090 -6.3279 -6.3279 -5.5913 -5.5913 -5.1947 -5.1947 -3.6236 -3.6236 -2.9570 -2.9570 -2.5212 -2.5212 -1.9978 -1.9978 -1.3701 -1.3701 -0.9995 -0.9995 -0.1726 -0.1726 0.1304 0.1304 0.1798 0.1798 0.2985 0.2985 0.3310 0.3310 0.4898 0.4898 0.6311 0.6311 2.0676 2.0676 2.5383 2.5383 2.6098 2.6098 2.7484 2.7484 2.8134 2.8134 3.2367 3.2367 3.3552 3.3552 3.6208 3.6208 3.7233 3.7233 3.8131 3.8131 4.8942 4.8942 5.8790 5.8790 6.1441 6.1441 8.1902 8.1902 8.8587 8.8587 9.3153 9.3153 9.4611 9.4611 k = 0.0000-0.0418 0.0258 ( 7851 PWs) bands (ev): -17.4472 -17.4472 -15.5871 -15.5871 -12.2766 -12.2766 -11.4996 -11.4996 -11.2990 -11.2990 -9.4617 -9.4617 -9.3098 -9.3098 -6.3278 -6.3278 -5.5911 -5.5911 -5.1916 -5.1916 -3.6210 -3.6210 -2.9569 -2.9569 -2.5243 -2.5243 -1.9985 -1.9985 -1.3792 -1.3792 -0.9999 -0.9999 -0.1634 -0.1634 0.1357 0.1357 0.1812 0.1812 0.2988 0.2988 0.3274 0.3274 0.4868 0.4868 0.6288 0.6288 2.0676 2.0676 2.5381 2.5381 2.6101 2.6101 2.7483 2.7483 2.8139 2.8139 3.2395 3.2395 3.3554 3.3554 3.6229 3.6229 3.7235 3.7235 3.8137 3.8137 4.8927 4.8927 5.8810 5.8810 6.1243 6.1243 8.2070 8.2070 8.8654 8.8654 9.3209 9.3209 9.4464 9.4464 k = 0.0000-0.0314 0.0193 ( 7849 PWs) bands (ev): -17.4473 -17.4473 -15.5871 -15.5871 -12.2755 -12.2755 -11.5018 -11.5018 -11.2975 -11.2975 -9.4625 -9.4625 -9.3104 -9.3104 -6.3277 -6.3277 -5.5909 -5.5909 -5.1892 -5.1892 -3.6189 -3.6189 -2.9567 -2.9567 -2.5267 -2.5267 -1.9990 -1.9990 -1.3866 -1.3866 -1.0001 -1.0001 -0.1558 -0.1558 0.1401 0.1401 0.1826 0.1826 0.2982 0.2982 0.3249 0.3249 0.4840 0.4840 0.6271 0.6271 2.0676 2.0676 2.5378 2.5378 2.6104 2.6104 2.7482 2.7482 2.8144 2.8144 3.2417 3.2417 3.3557 3.3557 3.6246 3.6246 3.7236 3.7236 3.8141 3.8141 4.8917 4.8917 5.8827 5.8827 6.1086 6.1086 8.2202 8.2202 8.8707 8.8707 9.3264 9.3264 9.4344 9.4344 k = 0.0000-0.0209 0.0129 ( 7845 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2748 -12.2748 -11.5035 -11.5035 -11.2963 -11.2963 -9.4631 -9.4631 -9.3109 -9.3109 -6.3276 -6.3276 -5.5907 -5.5907 -5.1874 -5.1874 -3.6174 -3.6174 -2.9566 -2.9566 -2.5285 -2.5285 -1.9994 -1.9994 -1.3920 -1.3920 -1.0003 -1.0003 -0.1502 -0.1502 0.1434 0.1434 0.1838 0.1838 0.2972 0.2972 0.3235 0.3235 0.4817 0.4817 0.6260 0.6260 2.0676 2.0676 2.5377 2.5377 2.6106 2.6106 2.7481 2.7481 2.8147 2.8147 3.2433 3.2433 3.3558 3.3558 3.6258 3.6258 3.7236 3.7236 3.8143 3.8143 4.8910 4.8910 5.8839 5.8839 6.0971 6.0971 8.2297 8.2297 8.8745 8.8745 9.3311 9.3311 9.4256 9.4256 k = 0.0000-0.0105 0.0064 ( 7843 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2743 -12.2743 -11.5045 -11.5045 -11.2956 -11.2956 -9.4634 -9.4634 -9.3112 -9.3112 -6.3275 -6.3275 -5.5906 -5.5906 -5.1863 -5.1863 -3.6164 -3.6164 -2.9565 -2.9565 -2.5296 -2.5296 -1.9997 -1.9997 -1.3953 -1.3953 -1.0004 -1.0004 -0.1467 -0.1467 0.1455 0.1455 0.1846 0.1846 0.2962 0.2962 0.3228 0.3228 0.4803 0.4803 0.6254 0.6254 2.0676 2.0676 2.5376 2.5376 2.6107 2.6107 2.7480 2.7480 2.8149 2.8149 3.2442 3.2442 3.3559 3.3559 3.6266 3.6266 3.7237 3.7237 3.8145 3.8145 4.8907 4.8907 5.8846 5.8846 6.0901 6.0901 8.2355 8.2355 8.8768 8.8768 9.3343 9.3343 9.4204 9.4204 k = 0.0000 0.0000 0.0000 ( 7841 PWs) bands (ev): -17.4473 -17.4473 -15.5870 -15.5870 -12.2742 -12.2742 -11.5048 -11.5048 -11.2954 -11.2954 -9.4635 -9.4635 -9.3113 -9.3113 -6.3275 -6.3275 -5.5906 -5.5906 -5.1860 -5.1860 -3.6161 -3.6161 -2.9565 -2.9565 -2.5299 -2.5299 -1.9997 -1.9997 -1.3964 -1.3964 -1.0004 -1.0004 -0.1455 -0.1455 0.1462 0.1462 0.1849 0.1849 0.2958 0.2958 0.3227 0.3227 0.4798 0.4798 0.6252 0.6252 2.0676 2.0676 2.5375 2.5375 2.6108 2.6108 2.7480 2.7480 2.8149 2.8149 3.2445 3.2445 3.3560 3.3560 3.6268 3.6268 3.7237 3.7237 3.8145 3.8145 4.8906 4.8906 5.8849 5.8849 6.0878 6.0878 8.2375 8.2375 8.8775 8.8775 9.3355 9.3355 9.4187 9.4187 Writing output data file CuH2C2BrN.save init_run : 0.54s CPU 0.77s WALL ( 1 calls) electrons : 256.46s CPU 260.86s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.02s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 256.45s CPU 260.85s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.08s CPU 0.13s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.13s WALL ( 260 calls) cegterg : 232.72s CPU 235.02s WALL ( 339 calls) Called by sum_band: Called by *egterg: h_psi : 126.66s CPU 128.21s WALL ( 5692 calls) s_psi : 8.91s CPU 8.86s WALL ( 5692 calls) g_psi : 0.46s CPU 0.48s WALL ( 5093 calls) cdiaghg : 76.31s CPU 77.29s WALL ( 5353 calls) cegterg:over : 14.68s CPU 14.89s WALL ( 5093 calls) cegterg:upda : 12.51s CPU 12.66s WALL ( 5093 calls) cegterg:last : 6.75s CPU 6.73s WALL ( 859 calls) cdiaghg:chol : 4.60s CPU 4.56s WALL ( 5353 calls) cdiaghg:inve : 3.18s CPU 3.32s WALL ( 5353 calls) cdiaghg:para : 5.64s CPU 5.65s WALL ( 10706 calls) Called by h_psi: h_psi:vloc : 105.81s CPU 107.19s WALL ( 5692 calls) h_psi:vnl : 20.26s CPU 20.45s WALL ( 5692 calls) add_vuspsi : 9.79s CPU 9.90s WALL ( 5692 calls) General routines calbec : 10.44s CPU 10.54s WALL ( 5692 calls) fft : 0.06s CPU 0.05s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 97.97s CPU 99.10s WALL ( 909040 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.42s WALL ( 520 calls) Parallel routines fft_scatter : 36.45s CPU 37.54s WALL ( 909063 calls) PWSCF : 4m43.97s CPU 5m14.84s WALL This run was terminated on: 16:17:12 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=