Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:13:25 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: ./C.save/ 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 22 11 3 326 109 21 Max 23 12 4 329 122 24 Sum 809 403 133 11779 4205 815 bravais-lattice index = 14 lattice parameter (alat) = 7.4956 a.u. unit-cell volume = 118.0260 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 1 number of electrons = 8.00 number of Kohn-Sham states= 16 kinetic-energy cutoff = 41.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.495625 celldm(2)= 0.899052 celldm(3)= 0.619193 celldm(4)= 0.172174 celldm(5)= 0.464399 celldm(6)= 0.792443 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.712448 0.548373 0.000000 ) a(3) = ( 0.287552 -0.198804 0.511067 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.299202 -1.068038 ) b(2) = ( 0.000000 1.823576 0.709368 ) b(3) = ( 0.000000 0.000000 1.956689 ) PseudoPot. # 1 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 atomic species valence mass pseudopotential C 4.00 12.01070 C( 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= 725 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0013793 k( 2) = ( 0.0067568 -0.0087784 0.0060044), wk = 0.0013793 k( 3) = ( 0.0135135 -0.0175568 0.0120088), wk = 0.0013793 k( 4) = ( 0.0202703 -0.0263352 0.0180132), wk = 0.0013793 k( 5) = ( 0.0270270 -0.0351136 0.0240176), wk = 0.0013793 k( 6) = ( 0.0337838 -0.0438920 0.0300220), wk = 0.0013793 k( 7) = ( 0.0405405 -0.0526704 0.0360264), wk = 0.0013793 k( 8) = ( 0.0472973 -0.0614488 0.0420308), wk = 0.0013793 k( 9) = ( 0.0540540 -0.0702271 0.0480352), wk = 0.0013793 k( 10) = ( 0.0608108 -0.0790055 0.0540396), wk = 0.0013793 k( 11) = ( 0.0675676 -0.0877839 0.0600440), wk = 0.0013793 k( 12) = ( 0.0743243 -0.0965623 0.0660484), wk = 0.0013793 k( 13) = ( 0.0810811 -0.1053407 0.0720528), wk = 0.0013793 k( 14) = ( 0.0878378 -0.1141191 0.0780572), wk = 0.0013793 k( 15) = ( 0.0945946 -0.1228975 0.0840616), wk = 0.0013793 k( 16) = ( 0.1013514 -0.1316759 0.0900660), wk = 0.0013793 k( 17) = ( 0.1081081 -0.1404543 0.0960704), wk = 0.0013793 k( 18) = ( 0.1148649 -0.1492327 0.1020748), wk = 0.0013793 k( 19) = ( 0.1216216 -0.1580111 0.1080792), wk = 0.0013793 k( 20) = ( 0.1283784 -0.1667895 0.1140836), wk = 0.0013793 k( 21) = ( 0.1351351 -0.1755679 0.1200880), wk = 0.0013793 k( 22) = ( 0.1418919 -0.1843463 0.1260924), wk = 0.0013793 k( 23) = ( 0.1486486 -0.1931247 0.1320968), wk = 0.0013793 k( 24) = ( 0.1554054 -0.2019031 0.1381012), wk = 0.0013793 k( 25) = ( 0.1621622 -0.2106814 0.1441055), wk = 0.0013793 k( 26) = ( 0.1689189 -0.2194598 0.1501100), wk = 0.0013793 k( 27) = ( 0.1756757 -0.2282382 0.1561144), wk = 0.0013793 k( 28) = ( 0.1824324 -0.2370166 0.1621187), wk = 0.0013793 k( 29) = ( 0.1891892 -0.2457950 0.1681231), wk = 0.0013793 k( 30) = ( 0.1959460 -0.2545734 0.1741275), wk = 0.0013793 k( 31) = ( 0.2027027 -0.2633518 0.1801319), wk = 0.0013793 k( 32) = ( 0.2094595 -0.2721302 0.1861363), wk = 0.0013793 k( 33) = ( 0.2162162 -0.2809086 0.1921407), wk = 0.0013793 k( 34) = ( 0.2229730 -0.2896870 0.1981451), wk = 0.0013793 k( 35) = ( 0.2297297 -0.2984654 0.2041495), wk = 0.0013793 k( 36) = ( 0.2364865 -0.3072438 0.2101539), wk = 0.0013793 k( 37) = ( 0.2432432 -0.3160222 0.2161583), wk = 0.0013793 k( 38) = ( 0.2500000 -0.3248006 0.2221627), wk = 0.0013793 k( 39) = ( 0.2567568 -0.3335790 0.2281671), wk = 0.0013793 k( 40) = ( 0.2635135 -0.3423574 0.2341715), wk = 0.0013793 k( 41) = ( 0.2702703 -0.3511357 0.2401759), wk = 0.0013793 k( 42) = ( 0.2770270 -0.3599141 0.2461803), wk = 0.0013793 k( 43) = ( 0.2837838 -0.3686925 0.2521847), wk = 0.0013793 k( 44) = ( 0.2905405 -0.3774709 0.2581891), wk = 0.0013793 k( 45) = ( 0.2972973 -0.3862493 0.2641935), wk = 0.0013793 k( 46) = ( 0.3040541 -0.3950277 0.2701979), wk = 0.0013793 k( 47) = ( 0.3108108 -0.4038061 0.2762023), wk = 0.0013793 k( 48) = ( 0.3175676 -0.4125845 0.2822067), wk = 0.0013793 k( 49) = ( 0.3243243 -0.4213629 0.2882111), wk = 0.0013793 k( 50) = ( 0.3310811 -0.4301413 0.2942155), wk = 0.0013793 k( 51) = ( 0.3378378 -0.4389197 0.3002199), wk = 0.0013793 k( 52) = ( 0.3445946 -0.4476981 0.3062243), wk = 0.0013793 k( 53) = ( 0.3513514 -0.4564765 0.3122287), wk = 0.0013793 k( 54) = ( 0.3581081 -0.4652549 0.3182331), wk = 0.0013793 k( 55) = ( 0.3648649 -0.4740333 0.3242375), wk = 0.0013793 k( 56) = ( 0.3716216 -0.4828117 0.3302419), wk = 0.0013793 k( 57) = ( 0.3783784 -0.4915901 0.3362463), wk = 0.0013793 k( 58) = ( 0.3851351 -0.5003684 0.3422507), wk = 0.0013793 k( 59) = ( 0.3918919 -0.5091468 0.3482551), wk = 0.0013793 k( 60) = ( 0.3986486 -0.5179252 0.3542595), wk = 0.0013793 k( 61) = ( 0.4054054 -0.5267036 0.3602639), wk = 0.0013793 k( 62) = ( 0.4121622 -0.5354820 0.3662683), wk = 0.0013793 k( 63) = ( 0.4189189 -0.5442604 0.3722727), wk = 0.0013793 k( 64) = ( 0.4256757 -0.5530388 0.3782771), wk = 0.0013793 k( 65) = ( 0.4324324 -0.5618172 0.3842815), wk = 0.0013793 k( 66) = ( 0.4391892 -0.5705956 0.3902859), wk = 0.0013793 k( 67) = ( 0.4459459 -0.5793740 0.3962903), wk = 0.0013793 k( 68) = ( 0.4527027 -0.5881524 0.4022947), wk = 0.0013793 k( 69) = ( 0.4594595 -0.5969308 0.4082991), wk = 0.0013793 k( 70) = ( 0.4662162 -0.6057092 0.4143035), wk = 0.0013793 k( 71) = ( 0.4729730 -0.6144876 0.4203079), wk = 0.0013793 k( 72) = ( 0.4797297 -0.6232660 0.4263123), wk = 0.0013793 k( 73) = ( 0.4864865 -0.6320444 0.4323167), wk = 0.0013793 k( 74) = ( 0.4932432 -0.6408227 0.4383210), wk = 0.0013793 k( 75) = ( 0.5000000 -0.6496011 0.4443255), wk = 0.0013793 k( 76) = ( 0.5000000 -0.6496011 0.4443255), wk = 0.0013793 k( 77) = ( 0.5106383 -0.6440227 0.4405098), wk = 0.0013793 k( 78) = ( 0.5212766 -0.6384442 0.4366942), wk = 0.0013793 k( 79) = ( 0.5319149 -0.6328658 0.4328785), wk = 0.0013793 k( 80) = ( 0.5425532 -0.6272874 0.4290629), wk = 0.0013793 k( 81) = ( 0.5531915 -0.6217089 0.4252472), wk = 0.0013793 k( 82) = ( 0.5638298 -0.6161305 0.4214316), wk = 0.0013793 k( 83) = ( 0.5744681 -0.6105520 0.4176160), wk = 0.0013793 k( 84) = ( 0.5851064 -0.6049736 0.4138003), wk = 0.0013793 k( 85) = ( 0.5957447 -0.5993951 0.4099847), wk = 0.0013793 k( 86) = ( 0.6063830 -0.5938167 0.4061690), wk = 0.0013793 k( 87) = ( 0.6170213 -0.5882383 0.4023534), wk = 0.0013793 k( 88) = ( 0.6276596 -0.5826598 0.3985378), wk = 0.0013793 k( 89) = ( 0.6382979 -0.5770814 0.3947221), wk = 0.0013793 k( 90) = ( 0.6489362 -0.5715029 0.3909065), wk = 0.0013793 k( 91) = ( 0.6595745 -0.5659245 0.3870908), wk = 0.0013793 k( 92) = ( 0.6702128 -0.5603460 0.3832752), wk = 0.0013793 k( 93) = ( 0.6808511 -0.5547676 0.3794596), wk = 0.0013793 k( 94) = ( 0.6914894 -0.5491892 0.3756439), wk = 0.0013793 k( 95) = ( 0.7021277 -0.5436107 0.3718283), wk = 0.0013793 k( 96) = ( 0.7127660 -0.5380323 0.3680126), wk = 0.0013793 k( 97) = ( 0.7234043 -0.5324538 0.3641970), wk = 0.0013793 k( 98) = ( 0.7340425 -0.5268754 0.3603814), wk = 0.0013793 k( 99) = ( 0.7446808 -0.5212969 0.3565657), wk = 0.0013793 k( 100) = ( 0.7553192 -0.5157185 0.3527501), wk = 0.0013793 k( 101) = ( 0.7659575 -0.5101401 0.3489344), wk = 0.0013793 k( 102) = ( 0.7765957 -0.5045616 0.3451188), wk = 0.0013793 k( 103) = ( 0.7872340 -0.4989832 0.3413032), wk = 0.0013793 k( 104) = ( 0.7978723 -0.4934047 0.3374875), wk = 0.0013793 k( 105) = ( 0.8085106 -0.4878263 0.3336719), wk = 0.0013793 k( 106) = ( 0.8191489 -0.4822478 0.3298562), wk = 0.0013793 k( 107) = ( 0.8297872 -0.4766694 0.3260406), wk = 0.0013793 k( 108) = ( 0.8404255 -0.4710910 0.3222250), wk = 0.0013793 k( 109) = ( 0.8510638 -0.4655125 0.3184093), wk = 0.0013793 k( 110) = ( 0.8617021 -0.4599341 0.3145937), wk = 0.0013793 k( 111) = ( 0.8723404 -0.4543556 0.3107780), wk = 0.0013793 k( 112) = ( 0.8829787 -0.4487772 0.3069624), wk = 0.0013793 k( 113) = ( 0.8936170 -0.4431987 0.3031468), wk = 0.0013793 k( 114) = ( 0.9042553 -0.4376203 0.2993311), wk = 0.0013793 k( 115) = ( 0.9148936 -0.4320419 0.2955155), wk = 0.0013793 k( 116) = ( 0.9255319 -0.4264634 0.2916998), wk = 0.0013793 k( 117) = ( 0.9361702 -0.4208850 0.2878842), wk = 0.0013793 k( 118) = ( 0.9468085 -0.4153065 0.2840686), wk = 0.0013793 k( 119) = ( 0.9574468 -0.4097281 0.2802529), wk = 0.0013793 k( 120) = ( 0.9680851 -0.4041496 0.2764373), wk = 0.0013793 k( 121) = ( 0.9787234 -0.3985712 0.2726216), wk = 0.0013793 k( 122) = ( 0.9893617 -0.3929928 0.2688060), wk = 0.0013793 k( 123) = ( 1.0000000 -0.3874143 0.2649904), wk = 0.0013793 k( 124) = ( 1.0000000 -0.3874143 0.2649904), wk = 0.0013793 k( 125) = ( 0.9932432 -0.3786359 0.2589860), wk = 0.0013793 k( 126) = ( 0.9864865 -0.3698575 0.2529816), wk = 0.0013793 k( 127) = ( 0.9797297 -0.3610791 0.2469772), wk = 0.0013793 k( 128) = ( 0.9729730 -0.3523007 0.2409728), wk = 0.0013793 k( 129) = ( 0.9662162 -0.3435224 0.2349684), wk = 0.0013793 k( 130) = ( 0.9594595 -0.3347440 0.2289640), wk = 0.0013793 k( 131) = ( 0.9527027 -0.3259656 0.2229596), wk = 0.0013793 k( 132) = ( 0.9459460 -0.3171872 0.2169552), wk = 0.0013793 k( 133) = ( 0.9391892 -0.3084088 0.2109508), wk = 0.0013793 k( 134) = ( 0.9324324 -0.2996304 0.2049464), wk = 0.0013793 k( 135) = ( 0.9256757 -0.2908520 0.1989420), wk = 0.0013793 k( 136) = ( 0.9189189 -0.2820736 0.1929376), wk = 0.0013793 k( 137) = ( 0.9121622 -0.2732952 0.1869332), wk = 0.0013793 k( 138) = ( 0.9054054 -0.2645168 0.1809288), wk = 0.0013793 k( 139) = ( 0.8986487 -0.2557384 0.1749244), wk = 0.0013793 k( 140) = ( 0.8918919 -0.2469600 0.1689200), wk = 0.0013793 k( 141) = ( 0.8851351 -0.2381816 0.1629156), wk = 0.0013793 k( 142) = ( 0.8783784 -0.2294032 0.1569112), wk = 0.0013793 k( 143) = ( 0.8716216 -0.2206248 0.1509068), wk = 0.0013793 k( 144) = ( 0.8648649 -0.2118464 0.1449024), wk = 0.0013793 k( 145) = ( 0.8581081 -0.2030680 0.1388980), wk = 0.0013793 k( 146) = ( 0.8513513 -0.1942897 0.1328936), wk = 0.0013793 k( 147) = ( 0.8445946 -0.1855113 0.1268892), wk = 0.0013793 k( 148) = ( 0.8378378 -0.1767329 0.1208848), wk = 0.0013793 k( 149) = ( 0.8310811 -0.1679545 0.1148804), wk = 0.0013793 k( 150) = ( 0.8243243 -0.1591761 0.1088760), wk = 0.0013793 k( 151) = ( 0.8175676 -0.1503977 0.1028716), wk = 0.0013793 k( 152) = ( 0.8108108 -0.1416193 0.0968672), wk = 0.0013793 k( 153) = ( 0.8040540 -0.1328409 0.0908628), wk = 0.0013793 k( 154) = ( 0.7972973 -0.1240625 0.0848584), wk = 0.0013793 k( 155) = ( 0.7905405 -0.1152841 0.0788540), wk = 0.0013793 k( 156) = ( 0.7837838 -0.1065057 0.0728496), wk = 0.0013793 k( 157) = ( 0.7770270 -0.0977273 0.0668452), wk = 0.0013793 k( 158) = ( 0.7702703 -0.0889489 0.0608408), wk = 0.0013793 k( 159) = ( 0.7635135 -0.0801705 0.0548364), wk = 0.0013793 k( 160) = ( 0.7567568 -0.0713921 0.0488320), wk = 0.0013793 k( 161) = ( 0.7500000 -0.0626137 0.0428276), wk = 0.0013793 k( 162) = ( 0.7432432 -0.0538353 0.0368232), wk = 0.0013793 k( 163) = ( 0.7364865 -0.0450570 0.0308188), wk = 0.0013793 k( 164) = ( 0.7297297 -0.0362786 0.0248144), wk = 0.0013793 k( 165) = ( 0.7229730 -0.0275002 0.0188100), wk = 0.0013793 k( 166) = ( 0.7162162 -0.0187218 0.0128057), wk = 0.0013793 k( 167) = ( 0.7094595 -0.0099434 0.0068012), wk = 0.0013793 k( 168) = ( 0.7027027 -0.0011650 0.0007968), wk = 0.0013793 k( 169) = ( 0.6959460 0.0076134 -0.0052075), wk = 0.0013793 k( 170) = ( 0.6891892 0.0163918 -0.0112119), wk = 0.0013793 k( 171) = ( 0.6824324 0.0251702 -0.0172163), wk = 0.0013793 k( 172) = ( 0.6756757 0.0339486 -0.0232207), wk = 0.0013793 k( 173) = ( 0.6689189 0.0427270 -0.0292251), wk = 0.0013793 k( 174) = ( 0.6621622 0.0515054 -0.0352295), wk = 0.0013793 k( 175) = ( 0.6554054 0.0602838 -0.0412339), wk = 0.0013793 k( 176) = ( 0.6486487 0.0690622 -0.0472383), wk = 0.0013793 k( 177) = ( 0.6418919 0.0778406 -0.0532427), wk = 0.0013793 k( 178) = ( 0.6351351 0.0866189 -0.0592471), wk = 0.0013793 k( 179) = ( 0.6283784 0.0953973 -0.0652515), wk = 0.0013793 k( 180) = ( 0.6216216 0.1041757 -0.0712559), wk = 0.0013793 k( 181) = ( 0.6148649 0.1129541 -0.0772603), wk = 0.0013793 k( 182) = ( 0.6081081 0.1217325 -0.0832647), wk = 0.0013793 k( 183) = ( 0.6013513 0.1305109 -0.0892691), wk = 0.0013793 k( 184) = ( 0.5945946 0.1392893 -0.0952735), wk = 0.0013793 k( 185) = ( 0.5878378 0.1480677 -0.1012779), wk = 0.0013793 k( 186) = ( 0.5810811 0.1568461 -0.1072823), wk = 0.0013793 k( 187) = ( 0.5743243 0.1656245 -0.1132867), wk = 0.0013793 k( 188) = ( 0.5675676 0.1744029 -0.1192911), wk = 0.0013793 k( 189) = ( 0.5608108 0.1831813 -0.1252955), wk = 0.0013793 k( 190) = ( 0.5540540 0.1919597 -0.1312999), wk = 0.0013793 k( 191) = ( 0.5472973 0.2007381 -0.1373043), wk = 0.0013793 k( 192) = ( 0.5405405 0.2095165 -0.1433087), wk = 0.0013793 k( 193) = ( 0.5337838 0.2182949 -0.1493131), wk = 0.0013793 k( 194) = ( 0.5270270 0.2270732 -0.1553175), wk = 0.0013793 k( 195) = ( 0.5202703 0.2358516 -0.1613219), wk = 0.0013793 k( 196) = ( 0.5135135 0.2446300 -0.1673263), wk = 0.0013793 k( 197) = ( 0.5067568 0.2534084 -0.1733307), wk = 0.0013793 k( 198) = ( 0.5000000 0.2621868 -0.1793351), wk = 0.0013793 k( 199) = ( 0.5000000 0.2621868 -0.1793351), wk = 0.0013793 k( 200) = ( 0.4893617 0.2566084 -0.1755194), wk = 0.0013793 k( 201) = ( 0.4787234 0.2510299 -0.1717038), wk = 0.0013793 k( 202) = ( 0.4680851 0.2454515 -0.1678882), wk = 0.0013793 k( 203) = ( 0.4574468 0.2398730 -0.1640725), wk = 0.0013793 k( 204) = ( 0.4468085 0.2342946 -0.1602569), wk = 0.0013793 k( 205) = ( 0.4361702 0.2287162 -0.1564412), wk = 0.0013793 k( 206) = ( 0.4255319 0.2231377 -0.1526256), wk = 0.0013793 k( 207) = ( 0.4148936 0.2175593 -0.1488100), wk = 0.0013793 k( 208) = ( 0.4042553 0.2119808 -0.1449943), wk = 0.0013793 k( 209) = ( 0.3936170 0.2064024 -0.1411787), wk = 0.0013793 k( 210) = ( 0.3829787 0.2008239 -0.1373630), wk = 0.0013793 k( 211) = ( 0.3723404 0.1952455 -0.1335474), wk = 0.0013793 k( 212) = ( 0.3617021 0.1896671 -0.1297318), wk = 0.0013793 k( 213) = ( 0.3510638 0.1840886 -0.1259161), wk = 0.0013793 k( 214) = ( 0.3404255 0.1785102 -0.1221005), wk = 0.0013793 k( 215) = ( 0.3297872 0.1729317 -0.1182848), wk = 0.0013793 k( 216) = ( 0.3191489 0.1673533 -0.1144692), wk = 0.0013793 k( 217) = ( 0.3085106 0.1617748 -0.1106536), wk = 0.0013793 k( 218) = ( 0.2978723 0.1561964 -0.1068379), wk = 0.0013793 k( 219) = ( 0.2872340 0.1506180 -0.1030223), wk = 0.0013793 k( 220) = ( 0.2765957 0.1450395 -0.0992066), wk = 0.0013793 k( 221) = ( 0.2659574 0.1394611 -0.0953910), wk = 0.0013793 k( 222) = ( 0.2553191 0.1338826 -0.0915754), wk = 0.0013793 k( 223) = ( 0.2446809 0.1283042 -0.0877597), wk = 0.0013793 k( 224) = ( 0.2340425 0.1227257 -0.0839441), wk = 0.0013793 k( 225) = ( 0.2234043 0.1171473 -0.0801284), wk = 0.0013793 k( 226) = ( 0.2127660 0.1115689 -0.0763128), wk = 0.0013793 k( 227) = ( 0.2021277 0.1059904 -0.0724972), wk = 0.0013793 k( 228) = ( 0.1914894 0.1004120 -0.0686815), wk = 0.0013793 k( 229) = ( 0.1808511 0.0948335 -0.0648659), wk = 0.0013793 k( 230) = ( 0.1702128 0.0892551 -0.0610502), wk = 0.0013793 k( 231) = ( 0.1595745 0.0836766 -0.0572346), wk = 0.0013793 k( 232) = ( 0.1489362 0.0780982 -0.0534190), wk = 0.0013793 k( 233) = ( 0.1382979 0.0725198 -0.0496033), wk = 0.0013793 k( 234) = ( 0.1276596 0.0669413 -0.0457877), wk = 0.0013793 k( 235) = ( 0.1170213 0.0613629 -0.0419720), wk = 0.0013793 k( 236) = ( 0.1063830 0.0557844 -0.0381564), wk = 0.0013793 k( 237) = ( 0.0957447 0.0502060 -0.0343408), wk = 0.0013793 k( 238) = ( 0.0851064 0.0446275 -0.0305251), wk = 0.0013793 k( 239) = ( 0.0744681 0.0390491 -0.0267095), wk = 0.0013793 k( 240) = ( 0.0638298 0.0334707 -0.0228938), wk = 0.0013793 k( 241) = ( 0.0531915 0.0278922 -0.0190782), wk = 0.0013793 k( 242) = ( 0.0425532 0.0223138 -0.0152626), wk = 0.0013793 k( 243) = ( 0.0319149 0.0167353 -0.0114469), wk = 0.0013793 k( 244) = ( 0.0212766 0.0111569 -0.0076313), wk = 0.0013793 k( 245) = ( 0.0106383 0.0055784 -0.0038156), wk = 0.0013793 k( 246) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0013793 k( 247) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0013793 k( 248) = ( 0.0000000 0.0071190 0.0104079), wk = 0.0013793 k( 249) = ( 0.0000000 0.0142380 0.0208159), wk = 0.0013793 k( 250) = ( 0.0000000 0.0213570 0.0312238), wk = 0.0013793 k( 251) = ( 0.0000000 0.0284760 0.0416317), wk = 0.0013793 k( 252) = ( 0.0000000 0.0355949 0.0520396), wk = 0.0013793 k( 253) = ( 0.0000000 0.0427139 0.0624475), wk = 0.0013793 k( 254) = ( 0.0000000 0.0498329 0.0728554), wk = 0.0013793 k( 255) = ( 0.0000000 0.0569519 0.0832634), wk = 0.0013793 k( 256) = ( 0.0000000 0.0640709 0.0936713), wk = 0.0013793 k( 257) = ( 0.0000000 0.0711899 0.1040792), wk = 0.0013793 k( 258) = ( 0.0000000 0.0783089 0.1144871), wk = 0.0013793 k( 259) = ( 0.0000000 0.0854279 0.1248950), wk = 0.0013793 k( 260) = ( 0.0000000 0.0925469 0.1353030), wk = 0.0013793 k( 261) = ( 0.0000000 0.0996659 0.1457109), wk = 0.0013793 k( 262) = ( 0.0000000 0.1067848 0.1561188), wk = 0.0013793 k( 263) = ( 0.0000000 0.1139038 0.1665267), wk = 0.0013793 k( 264) = ( 0.0000000 0.1210228 0.1769347), wk = 0.0013793 k( 265) = ( 0.0000000 0.1281418 0.1873426), wk = 0.0013793 k( 266) = ( 0.0000000 0.1352608 0.1977505), wk = 0.0013793 k( 267) = ( 0.0000000 0.1423798 0.2081584), wk = 0.0013793 k( 268) = ( 0.0000000 0.1494988 0.2185663), wk = 0.0013793 k( 269) = ( 0.0000000 0.1566178 0.2289743), wk = 0.0013793 k( 270) = ( 0.0000000 0.1637368 0.2393822), wk = 0.0013793 k( 271) = ( 0.0000000 0.1708558 0.2497901), wk = 0.0013793 k( 272) = ( 0.0000000 0.1779748 0.2601980), wk = 0.0013793 k( 273) = ( 0.0000000 0.1850937 0.2706059), wk = 0.0013793 k( 274) = ( 0.0000000 0.1922127 0.2810138), wk = 0.0013793 k( 275) = ( 0.0000000 0.1993317 0.2914218), wk = 0.0013793 k( 276) = ( 0.0000000 0.2064507 0.3018297), wk = 0.0013793 k( 277) = ( 0.0000000 0.2135697 0.3122376), wk = 0.0013793 k( 278) = ( 0.0000000 0.2206887 0.3226455), wk = 0.0013793 k( 279) = ( 0.0000000 0.2278077 0.3330535), wk = 0.0013793 k( 280) = ( 0.0000000 0.2349267 0.3434614), wk = 0.0013793 k( 281) = ( 0.0000000 0.2420457 0.3538693), wk = 0.0013793 k( 282) = ( 0.0000000 0.2491646 0.3642772), wk = 0.0013793 k( 283) = ( 0.0000000 0.2562836 0.3746851), wk = 0.0013793 k( 284) = ( 0.0000000 0.2634026 0.3850931), wk = 0.0013793 k( 285) = ( 0.0000000 0.2705216 0.3955010), wk = 0.0013793 k( 286) = ( 0.0000000 0.2776406 0.4059089), wk = 0.0013793 k( 287) = ( 0.0000000 0.2847596 0.4163168), wk = 0.0013793 k( 288) = ( 0.0000000 0.2918786 0.4267247), wk = 0.0013793 k( 289) = ( 0.0000000 0.2989976 0.4371327), wk = 0.0013793 k( 290) = ( 0.0000000 0.3061166 0.4475406), wk = 0.0013793 k( 291) = ( 0.0000000 0.3132356 0.4579485), wk = 0.0013793 k( 292) = ( 0.0000000 0.3203545 0.4683564), wk = 0.0013793 k( 293) = ( 0.0000000 0.3274735 0.4787643), wk = 0.0013793 k( 294) = ( 0.0000000 0.3345925 0.4891723), wk = 0.0013793 k( 295) = ( 0.0000000 0.3417115 0.4995802), wk = 0.0013793 k( 296) = ( 0.0000000 0.3488305 0.5099881), wk = 0.0013793 k( 297) = ( 0.0000000 0.3559495 0.5203960), wk = 0.0013793 k( 298) = ( 0.0000000 0.3630685 0.5308040), wk = 0.0013793 k( 299) = ( 0.0000000 0.3701875 0.5412119), wk = 0.0013793 k( 300) = ( 0.0000000 0.3773065 0.5516198), wk = 0.0013793 k( 301) = ( 0.0000000 0.3844254 0.5620277), wk = 0.0013793 k( 302) = ( 0.0000000 0.3915445 0.5724356), wk = 0.0013793 k( 303) = ( 0.0000000 0.3986634 0.5828435), wk = 0.0013793 k( 304) = ( 0.0000000 0.4057824 0.5932515), wk = 0.0013793 k( 305) = ( 0.0000000 0.4129014 0.6036594), wk = 0.0013793 k( 306) = ( 0.0000000 0.4200204 0.6140673), wk = 0.0013793 k( 307) = ( 0.0000000 0.4271394 0.6244752), wk = 0.0013793 k( 308) = ( 0.0000000 0.4342584 0.6348831), wk = 0.0013793 k( 309) = ( 0.0000000 0.4413774 0.6452911), wk = 0.0013793 k( 310) = ( 0.0000000 0.4484964 0.6556990), wk = 0.0013793 k( 311) = ( 0.0000000 0.4556154 0.6661069), wk = 0.0013793 k( 312) = ( 0.0000000 0.4627343 0.6765148), wk = 0.0013793 k( 313) = ( 0.0000000 0.4698533 0.6869228), wk = 0.0013793 k( 314) = ( 0.0000000 0.4769723 0.6973307), wk = 0.0013793 k( 315) = ( 0.0000000 0.4840913 0.7077386), wk = 0.0013793 k( 316) = ( 0.0000000 0.4912103 0.7181465), wk = 0.0013793 k( 317) = ( 0.0000000 0.4983293 0.7285544), wk = 0.0013793 k( 318) = ( 0.0000000 0.5054483 0.7389624), wk = 0.0013793 k( 319) = ( 0.0000000 0.5125673 0.7493703), wk = 0.0013793 k( 320) = ( 0.0000000 0.5196863 0.7597782), wk = 0.0013793 k( 321) = ( 0.0000000 0.5268053 0.7701861), wk = 0.0013793 k( 322) = ( 0.0000000 0.5339242 0.7805940), wk = 0.0013793 k( 323) = ( 0.0000000 0.5410432 0.7910019), wk = 0.0013793 k( 324) = ( 0.0000000 0.5481622 0.8014099), wk = 0.0013793 k( 325) = ( 0.0000000 0.5552812 0.8118178), wk = 0.0013793 k( 326) = ( 0.0000000 0.5624002 0.8222257), wk = 0.0013793 k( 327) = ( 0.0000000 0.5695192 0.8326336), wk = 0.0013793 k( 328) = ( 0.0000000 0.5766382 0.8430416), wk = 0.0013793 k( 329) = ( 0.0000000 0.5837572 0.8534495), wk = 0.0013793 k( 330) = ( 0.0000000 0.5908762 0.8638574), wk = 0.0013793 k( 331) = ( 0.0000000 0.5979951 0.8742653), wk = 0.0013793 k( 332) = ( 0.0000000 0.6051141 0.8846732), wk = 0.0013793 k( 333) = ( 0.0000000 0.6122331 0.8950812), wk = 0.0013793 k( 334) = ( 0.0000000 0.6193521 0.9054891), wk = 0.0013793 k( 335) = ( 0.0000000 0.6264711 0.9158970), wk = 0.0013793 k( 336) = ( 0.0000000 0.6335901 0.9263049), wk = 0.0013793 k( 337) = ( 0.0000000 0.6407091 0.9367128), wk = 0.0013793 k( 338) = ( 0.0000000 0.6478281 0.9471208), wk = 0.0013793 k( 339) = ( 0.0000000 0.6549471 0.9575287), wk = 0.0013793 k( 340) = ( 0.0000000 0.6620661 0.9679366), wk = 0.0013793 k( 341) = ( 0.0000000 0.6691851 0.9783445), wk = 0.0013793 k( 342) = ( 0.0000000 0.6691851 0.9783445), wk = 0.0013793 k( 343) = ( 0.0058140 0.6580976 0.9783445), wk = 0.0013793 k( 344) = ( 0.0116279 0.6470102 0.9783445), wk = 0.0013793 k( 345) = ( 0.0174419 0.6359228 0.9783445), wk = 0.0013793 k( 346) = ( 0.0232558 0.6248354 0.9783445), wk = 0.0013793 k( 347) = ( 0.0290698 0.6137479 0.9783445), wk = 0.0013793 k( 348) = ( 0.0348837 0.6026605 0.9783445), wk = 0.0013793 k( 349) = ( 0.0406977 0.5915731 0.9783445), wk = 0.0013793 k( 350) = ( 0.0465116 0.5804856 0.9783445), wk = 0.0013793 k( 351) = ( 0.0523256 0.5693982 0.9783445), wk = 0.0013793 k( 352) = ( 0.0581395 0.5583108 0.9783445), wk = 0.0013793 k( 353) = ( 0.0639535 0.5472234 0.9783445), wk = 0.0013793 k( 354) = ( 0.0697674 0.5361360 0.9783445), wk = 0.0013793 k( 355) = ( 0.0755814 0.5250485 0.9783445), wk = 0.0013793 k( 356) = ( 0.0813954 0.5139611 0.9783445), wk = 0.0013793 k( 357) = ( 0.0872093 0.5028737 0.9783445), wk = 0.0013793 k( 358) = ( 0.0930233 0.4917862 0.9783445), wk = 0.0013793 k( 359) = ( 0.0988372 0.4806988 0.9783445), wk = 0.0013793 k( 360) = ( 0.1046512 0.4696114 0.9783445), wk = 0.0013793 k( 361) = ( 0.1104651 0.4585240 0.9783445), wk = 0.0013793 k( 362) = ( 0.1162791 0.4474366 0.9783445), wk = 0.0013793 k( 363) = ( 0.1220930 0.4363491 0.9783445), wk = 0.0013793 k( 364) = ( 0.1279070 0.4252617 0.9783445), wk = 0.0013793 k( 365) = ( 0.1337209 0.4141743 0.9783445), wk = 0.0013793 k( 366) = ( 0.1395349 0.4030868 0.9783445), wk = 0.0013793 k( 367) = ( 0.1453488 0.3919994 0.9783445), wk = 0.0013793 k( 368) = ( 0.1511628 0.3809120 0.9783445), wk = 0.0013793 k( 369) = ( 0.1569767 0.3698246 0.9783445), wk = 0.0013793 k( 370) = ( 0.1627907 0.3587371 0.9783445), wk = 0.0013793 k( 371) = ( 0.1686046 0.3476497 0.9783445), wk = 0.0013793 k( 372) = ( 0.1744186 0.3365623 0.9783445), wk = 0.0013793 k( 373) = ( 0.1802326 0.3254749 0.9783445), wk = 0.0013793 k( 374) = ( 0.1860465 0.3143874 0.9783445), wk = 0.0013793 k( 375) = ( 0.1918605 0.3033000 0.9783445), wk = 0.0013793 k( 376) = ( 0.1976744 0.2922126 0.9783445), wk = 0.0013793 k( 377) = ( 0.2034884 0.2811252 0.9783445), wk = 0.0013793 k( 378) = ( 0.2093023 0.2700377 0.9783445), wk = 0.0013793 k( 379) = ( 0.2151163 0.2589503 0.9783445), wk = 0.0013793 k( 380) = ( 0.2209302 0.2478629 0.9783445), wk = 0.0013793 k( 381) = ( 0.2267442 0.2367755 0.9783445), wk = 0.0013793 k( 382) = ( 0.2325581 0.2256880 0.9783445), wk = 0.0013793 k( 383) = ( 0.2383721 0.2146006 0.9783445), wk = 0.0013793 k( 384) = ( 0.2441860 0.2035132 0.9783445), wk = 0.0013793 k( 385) = ( 0.2500000 0.1924258 0.9783445), wk = 0.0013793 k( 386) = ( 0.2558140 0.1813384 0.9783445), wk = 0.0013793 k( 387) = ( 0.2616279 0.1702509 0.9783445), wk = 0.0013793 k( 388) = ( 0.2674419 0.1591635 0.9783445), wk = 0.0013793 k( 389) = ( 0.2732558 0.1480761 0.9783445), wk = 0.0013793 k( 390) = ( 0.2790698 0.1369886 0.9783445), wk = 0.0013793 k( 391) = ( 0.2848837 0.1259012 0.9783445), wk = 0.0013793 k( 392) = ( 0.2906977 0.1148138 0.9783445), wk = 0.0013793 k( 393) = ( 0.2965116 0.1037264 0.9783445), wk = 0.0013793 k( 394) = ( 0.3023256 0.0926389 0.9783445), wk = 0.0013793 k( 395) = ( 0.3081395 0.0815515 0.9783445), wk = 0.0013793 k( 396) = ( 0.3139535 0.0704641 0.9783445), wk = 0.0013793 k( 397) = ( 0.3197674 0.0593767 0.9783445), wk = 0.0013793 k( 398) = ( 0.3255814 0.0482892 0.9783445), wk = 0.0013793 k( 399) = ( 0.3313953 0.0372018 0.9783445), wk = 0.0013793 k( 400) = ( 0.3372093 0.0261144 0.9783445), wk = 0.0013793 k( 401) = ( 0.3430233 0.0150270 0.9783445), wk = 0.0013793 k( 402) = ( 0.3488372 0.0039395 0.9783445), wk = 0.0013793 k( 403) = ( 0.3546512 -0.0071479 0.9783445), wk = 0.0013793 k( 404) = ( 0.3604651 -0.0182353 0.9783445), wk = 0.0013793 k( 405) = ( 0.3662791 -0.0293227 0.9783445), wk = 0.0013793 k( 406) = ( 0.3720930 -0.0404101 0.9783445), wk = 0.0013793 k( 407) = ( 0.3779070 -0.0514976 0.9783445), wk = 0.0013793 k( 408) = ( 0.3837209 -0.0625850 0.9783445), wk = 0.0013793 k( 409) = ( 0.3895349 -0.0736724 0.9783445), wk = 0.0013793 k( 410) = ( 0.3953488 -0.0847599 0.9783445), wk = 0.0013793 k( 411) = ( 0.4011628 -0.0958473 0.9783445), wk = 0.0013793 k( 412) = ( 0.4069767 -0.1069347 0.9783445), wk = 0.0013793 k( 413) = ( 0.4127907 -0.1180221 0.9783445), wk = 0.0013793 k( 414) = ( 0.4186047 -0.1291095 0.9783445), wk = 0.0013793 k( 415) = ( 0.4244186 -0.1401970 0.9783445), wk = 0.0013793 k( 416) = ( 0.4302326 -0.1512844 0.9783445), wk = 0.0013793 k( 417) = ( 0.4360465 -0.1623718 0.9783445), wk = 0.0013793 k( 418) = ( 0.4418605 -0.1734593 0.9783445), wk = 0.0013793 k( 419) = ( 0.4476744 -0.1845467 0.9783445), wk = 0.0013793 k( 420) = ( 0.4534884 -0.1956341 0.9783445), wk = 0.0013793 k( 421) = ( 0.4593023 -0.2067215 0.9783445), wk = 0.0013793 k( 422) = ( 0.4651163 -0.2178090 0.9783445), wk = 0.0013793 k( 423) = ( 0.4709302 -0.2288964 0.9783445), wk = 0.0013793 k( 424) = ( 0.4767442 -0.2399838 0.9783445), wk = 0.0013793 k( 425) = ( 0.4825581 -0.2510712 0.9783445), wk = 0.0013793 k( 426) = ( 0.4883721 -0.2621587 0.9783445), wk = 0.0013793 k( 427) = ( 0.4941860 -0.2732461 0.9783445), wk = 0.0013793 k( 428) = ( 0.5000000 -0.2843335 0.9783445), wk = 0.0013793 k( 429) = ( 0.5000000 -0.2843335 0.9783445), wk = 0.0013793 k( 430) = ( 0.5000000 -0.2913579 0.9680749), wk = 0.0013793 k( 431) = ( 0.5000000 -0.2983823 0.9578053), wk = 0.0013793 k( 432) = ( 0.5000000 -0.3054066 0.9475357), wk = 0.0013793 k( 433) = ( 0.5000000 -0.3124310 0.9372661), wk = 0.0013793 k( 434) = ( 0.5000000 -0.3194554 0.9269965), wk = 0.0013793 k( 435) = ( 0.5000000 -0.3264798 0.9167269), wk = 0.0013793 k( 436) = ( 0.5000000 -0.3335041 0.9064573), wk = 0.0013793 k( 437) = ( 0.5000000 -0.3405285 0.8961877), wk = 0.0013793 k( 438) = ( 0.5000000 -0.3475529 0.8859181), wk = 0.0013793 k( 439) = ( 0.5000000 -0.3545773 0.8756486), wk = 0.0013793 k( 440) = ( 0.5000000 -0.3616017 0.8653790), wk = 0.0013793 k( 441) = ( 0.5000000 -0.3686260 0.8551094), wk = 0.0013793 k( 442) = ( 0.5000000 -0.3756504 0.8448398), wk = 0.0013793 k( 443) = ( 0.5000000 -0.3826748 0.8345702), wk = 0.0013793 k( 444) = ( 0.5000000 -0.3896992 0.8243006), wk = 0.0013793 k( 445) = ( 0.5000000 -0.3967235 0.8140310), wk = 0.0013793 k( 446) = ( 0.5000000 -0.4037479 0.8037614), wk = 0.0013793 k( 447) = ( 0.5000000 -0.4107723 0.7934918), wk = 0.0013793 k( 448) = ( 0.5000000 -0.4177967 0.7832222), wk = 0.0013793 k( 449) = ( 0.5000000 -0.4248211 0.7729526), wk = 0.0013793 k( 450) = ( 0.5000000 -0.4318454 0.7626830), wk = 0.0013793 k( 451) = ( 0.5000000 -0.4388698 0.7524134), wk = 0.0013793 k( 452) = ( 0.5000000 -0.4458942 0.7421438), wk = 0.0013793 k( 453) = ( 0.5000000 -0.4529186 0.7318742), wk = 0.0013793 k( 454) = ( 0.5000000 -0.4599429 0.7216046), wk = 0.0013793 k( 455) = ( 0.5000000 -0.4669673 0.7113350), wk = 0.0013793 k( 456) = ( 0.5000000 -0.4739917 0.7010654), wk = 0.0013793 k( 457) = ( 0.5000000 -0.4810161 0.6907958), wk = 0.0013793 k( 458) = ( 0.5000000 -0.4880405 0.6805262), wk = 0.0013793 k( 459) = ( 0.5000000 -0.4950648 0.6702566), wk = 0.0013793 k( 460) = ( 0.5000000 -0.5020892 0.6599870), wk = 0.0013793 k( 461) = ( 0.5000000 -0.5091136 0.6497174), wk = 0.0013793 k( 462) = ( 0.5000000 -0.5161380 0.6394478), wk = 0.0013793 k( 463) = ( 0.5000000 -0.5231624 0.6291782), wk = 0.0013793 k( 464) = ( 0.5000000 -0.5301867 0.6189086), wk = 0.0013793 k( 465) = ( 0.5000000 -0.5372111 0.6086390), wk = 0.0013793 k( 466) = ( 0.5000000 -0.5442355 0.5983694), wk = 0.0013793 k( 467) = ( 0.5000000 -0.5512598 0.5880998), wk = 0.0013793 k( 468) = ( 0.5000000 -0.5582842 0.5778302), wk = 0.0013793 k( 469) = ( 0.5000000 -0.5653086 0.5675606), wk = 0.0013793 k( 470) = ( 0.5000000 -0.5723330 0.5572910), wk = 0.0013793 k( 471) = ( 0.5000000 -0.5793574 0.5470214), wk = 0.0013793 k( 472) = ( 0.5000000 -0.5863817 0.5367518), wk = 0.0013793 k( 473) = ( 0.5000000 -0.5934061 0.5264822), wk = 0.0013793 k( 474) = ( 0.5000000 -0.6004305 0.5162126), wk = 0.0013793 k( 475) = ( 0.5000000 -0.6074549 0.5059430), wk = 0.0013793 k( 476) = ( 0.5000000 -0.6144792 0.4956734), wk = 0.0013793 k( 477) = ( 0.5000000 -0.6215036 0.4854038), wk = 0.0013793 k( 478) = ( 0.5000000 -0.6285280 0.4751342), wk = 0.0013793 k( 479) = ( 0.5000000 -0.6355524 0.4648646), wk = 0.0013793 k( 480) = ( 0.5000000 -0.6425768 0.4545950), wk = 0.0013793 k( 481) = ( 0.5000000 -0.6496011 0.4443255), wk = 0.0013793 k( 482) = ( 1.0000000 -0.3874143 0.2649904), wk = 0.0013793 k( 483) = ( 1.0000000 -0.3804828 0.2751242), wk = 0.0013793 k( 484) = ( 1.0000000 -0.3735513 0.2852580), wk = 0.0013793 k( 485) = ( 1.0000000 -0.3666198 0.2953918), wk = 0.0013793 k( 486) = ( 1.0000000 -0.3596883 0.3055257), wk = 0.0013793 k( 487) = ( 1.0000000 -0.3527568 0.3156595), wk = 0.0013793 k( 488) = ( 1.0000000 -0.3458252 0.3257933), wk = 0.0013793 k( 489) = ( 1.0000000 -0.3388937 0.3359272), wk = 0.0013793 k( 490) = ( 1.0000000 -0.3319622 0.3460610), wk = 0.0013793 k( 491) = ( 1.0000000 -0.3250307 0.3561948), wk = 0.0013793 k( 492) = ( 1.0000000 -0.3180992 0.3663287), wk = 0.0013793 k( 493) = ( 1.0000000 -0.3111677 0.3764625), wk = 0.0013793 k( 494) = ( 1.0000000 -0.3042362 0.3865963), wk = 0.0013793 k( 495) = ( 1.0000000 -0.2973047 0.3967301), wk = 0.0013793 k( 496) = ( 1.0000000 -0.2903732 0.4068639), wk = 0.0013793 k( 497) = ( 1.0000000 -0.2834416 0.4169978), wk = 0.0013793 k( 498) = ( 1.0000000 -0.2765101 0.4271316), wk = 0.0013793 k( 499) = ( 1.0000000 -0.2695786 0.4372654), wk = 0.0013793 k( 500) = ( 1.0000000 -0.2626471 0.4473993), wk = 0.0013793 k( 501) = ( 1.0000000 -0.2557156 0.4575331), wk = 0.0013793 k( 502) = ( 1.0000000 -0.2487841 0.4676669), wk = 0.0013793 k( 503) = ( 1.0000000 -0.2418526 0.4778008), wk = 0.0013793 k( 504) = ( 1.0000000 -0.2349211 0.4879346), wk = 0.0013793 k( 505) = ( 1.0000000 -0.2279896 0.4980684), wk = 0.0013793 k( 506) = ( 1.0000000 -0.2210580 0.5082022), wk = 0.0013793 k( 507) = ( 1.0000000 -0.2141265 0.5183361), wk = 0.0013793 k( 508) = ( 1.0000000 -0.2071950 0.5284699), wk = 0.0013793 k( 509) = ( 1.0000000 -0.2002635 0.5386037), wk = 0.0013793 k( 510) = ( 1.0000000 -0.1933320 0.5487376), wk = 0.0013793 k( 511) = ( 1.0000000 -0.1864005 0.5588714), wk = 0.0013793 k( 512) = ( 1.0000000 -0.1794690 0.5690052), wk = 0.0013793 k( 513) = ( 1.0000000 -0.1725375 0.5791390), wk = 0.0013793 k( 514) = ( 1.0000000 -0.1656059 0.5892729), wk = 0.0013793 k( 515) = ( 1.0000000 -0.1586744 0.5994067), wk = 0.0013793 k( 516) = ( 1.0000000 -0.1517429 0.6095405), wk = 0.0013793 k( 517) = ( 1.0000000 -0.1448114 0.6196743), wk = 0.0013793 k( 518) = ( 0.0000000 0.6691851 0.9783445), wk = 0.0013793 k( 519) = ( 0.0100000 0.6719755 0.9711711), wk = 0.0013793 k( 520) = ( 0.0200000 0.6747659 0.9639977), wk = 0.0013793 k( 521) = ( 0.0300000 0.6775564 0.9568243), wk = 0.0013793 k( 522) = ( 0.0400000 0.6803468 0.9496509), wk = 0.0013793 k( 523) = ( 0.0500000 0.6831373 0.9424775), wk = 0.0013793 k( 524) = ( 0.0600000 0.6859277 0.9353041), wk = 0.0013793 k( 525) = ( 0.0700000 0.6887182 0.9281307), wk = 0.0013793 k( 526) = ( 0.0800000 0.6915086 0.9209573), wk = 0.0013793 k( 527) = ( 0.0900000 0.6942990 0.9137839), wk = 0.0013793 k( 528) = ( 0.1000000 0.6970895 0.9066105), wk = 0.0013793 k( 529) = ( 0.1100000 0.6998799 0.8994371), wk = 0.0013793 k( 530) = ( 0.1200000 0.7026704 0.8922637), wk = 0.0013793 k( 531) = ( 0.1300000 0.7054608 0.8850903), wk = 0.0013793 k( 532) = ( 0.1400000 0.7082512 0.8779169), wk = 0.0013793 k( 533) = ( 0.1500000 0.7110417 0.8707435), wk = 0.0013793 k( 534) = ( 0.1600000 0.7138321 0.8635701), wk = 0.0013793 k( 535) = ( 0.1700000 0.7166226 0.8563967), wk = 0.0013793 k( 536) = ( 0.1800000 0.7194130 0.8492233), wk = 0.0013793 k( 537) = ( 0.1900000 0.7222035 0.8420499), wk = 0.0013793 k( 538) = ( 0.2000000 0.7249939 0.8348765), wk = 0.0013793 k( 539) = ( 0.2100000 0.7277843 0.8277031), wk = 0.0013793 k( 540) = ( 0.2200000 0.7305748 0.8205297), wk = 0.0013793 k( 541) = ( 0.2300000 0.7333652 0.8133562), wk = 0.0013793 k( 542) = ( 0.2400000 0.7361557 0.8061828), wk = 0.0013793 k( 543) = ( 0.2500000 0.7389461 0.7990094), wk = 0.0013793 k( 544) = ( 0.2600000 0.7417365 0.7918360), wk = 0.0013793 k( 545) = ( 0.2700000 0.7445270 0.7846626), wk = 0.0013793 k( 546) = ( 0.2800000 0.7473174 0.7774892), wk = 0.0013793 k( 547) = ( 0.2900000 0.7501079 0.7703158), wk = 0.0013793 k( 548) = ( 0.3000000 0.7528983 0.7631424), wk = 0.0013793 k( 549) = ( 0.3100000 0.7556888 0.7559690), wk = 0.0013793 k( 550) = ( 0.3200000 0.7584792 0.7487956), wk = 0.0013793 k( 551) = ( 0.3300000 0.7612696 0.7416222), wk = 0.0013793 k( 552) = ( 0.3400000 0.7640601 0.7344488), wk = 0.0013793 k( 553) = ( 0.3500000 0.7668505 0.7272754), wk = 0.0013793 k( 554) = ( 0.3600000 0.7696410 0.7201020), wk = 0.0013793 k( 555) = ( 0.3700000 0.7724314 0.7129286), wk = 0.0013793 k( 556) = ( 0.3800000 0.7752218 0.7057552), wk = 0.0013793 k( 557) = ( 0.3900000 0.7780123 0.6985818), wk = 0.0013793 k( 558) = ( 0.4000000 0.7808027 0.6914084), wk = 0.0013793 k( 559) = ( 0.4100000 0.7835932 0.6842350), wk = 0.0013793 k( 560) = ( 0.4200000 0.7863836 0.6770616), wk = 0.0013793 k( 561) = ( 0.4300000 0.7891741 0.6698882), wk = 0.0013793 k( 562) = ( 0.4400000 0.7919645 0.6627148), wk = 0.0013793 k( 563) = ( 0.4500000 0.7947549 0.6555414), wk = 0.0013793 k( 564) = ( 0.4600000 0.7975454 0.6483680), wk = 0.0013793 k( 565) = ( 0.4700000 0.8003358 0.6411946), wk = 0.0013793 k( 566) = ( 0.4800000 0.8031263 0.6340212), wk = 0.0013793 k( 567) = ( 0.4900000 0.8059167 0.6268478), wk = 0.0013793 k( 568) = ( 0.5000000 0.8087071 0.6196743), wk = 0.0013793 k( 569) = ( 0.5000000 0.8087071 0.6196743), wk = 0.0013793 k( 570) = ( 0.5000000 0.8016095 0.6092976), wk = 0.0013793 k( 571) = ( 0.5000000 0.7945118 0.5989209), wk = 0.0013793 k( 572) = ( 0.5000000 0.7874142 0.5885441), wk = 0.0013793 k( 573) = ( 0.5000000 0.7803165 0.5781674), wk = 0.0013793 k( 574) = ( 0.5000000 0.7732188 0.5677906), wk = 0.0013793 k( 575) = ( 0.5000000 0.7661212 0.5574139), wk = 0.0013793 k( 576) = ( 0.5000000 0.7590235 0.5470371), wk = 0.0013793 k( 577) = ( 0.5000000 0.7519258 0.5366604), wk = 0.0013793 k( 578) = ( 0.5000000 0.7448282 0.5262836), wk = 0.0013793 k( 579) = ( 0.5000000 0.7377305 0.5159069), wk = 0.0013793 k( 580) = ( 0.5000000 0.7306328 0.5055301), wk = 0.0013793 k( 581) = ( 0.5000000 0.7235351 0.4951534), wk = 0.0013793 k( 582) = ( 0.5000000 0.7164375 0.4847766), wk = 0.0013793 k( 583) = ( 0.5000000 0.7093398 0.4743999), wk = 0.0013793 k( 584) = ( 0.5000000 0.7022421 0.4640232), wk = 0.0013793 k( 585) = ( 0.5000000 0.6951445 0.4536464), wk = 0.0013793 k( 586) = ( 0.5000000 0.6880468 0.4432697), wk = 0.0013793 k( 587) = ( 0.5000000 0.6809491 0.4328929), wk = 0.0013793 k( 588) = ( 0.5000000 0.6738515 0.4225162), wk = 0.0013793 k( 589) = ( 0.5000000 0.6667538 0.4121394), wk = 0.0013793 k( 590) = ( 0.5000000 0.6596561 0.4017627), wk = 0.0013793 k( 591) = ( 0.5000000 0.6525585 0.3913859), wk = 0.0013793 k( 592) = ( 0.5000000 0.6454608 0.3810092), wk = 0.0013793 k( 593) = ( 0.5000000 0.6383632 0.3706325), wk = 0.0013793 k( 594) = ( 0.5000000 0.6312655 0.3602557), wk = 0.0013793 k( 595) = ( 0.5000000 0.6241678 0.3498790), wk = 0.0013793 k( 596) = ( 0.5000000 0.6170702 0.3395022), wk = 0.0013793 k( 597) = ( 0.5000000 0.6099725 0.3291255), wk = 0.0013793 k( 598) = ( 0.5000000 0.6028748 0.3187487), wk = 0.0013793 k( 599) = ( 0.5000000 0.5957772 0.3083720), wk = 0.0013793 k( 600) = ( 0.5000000 0.5886795 0.2979952), wk = 0.0013793 k( 601) = ( 0.5000000 0.5815818 0.2876185), wk = 0.0013793 k( 602) = ( 0.5000000 0.5744842 0.2772417), wk = 0.0013793 k( 603) = ( 0.5000000 0.5673865 0.2668650), wk = 0.0013793 k( 604) = ( 0.5000000 0.5602888 0.2564882), wk = 0.0013793 k( 605) = ( 0.5000000 0.5531911 0.2461115), wk = 0.0013793 k( 606) = ( 0.5000000 0.5460935 0.2357347), wk = 0.0013793 k( 607) = ( 0.5000000 0.5389958 0.2253580), wk = 0.0013793 k( 608) = ( 0.5000000 0.5318981 0.2149812), wk = 0.0013793 k( 609) = ( 0.5000000 0.5248005 0.2046045), wk = 0.0013793 k( 610) = ( 0.5000000 0.5177028 0.1942278), wk = 0.0013793 k( 611) = ( 0.5000000 0.5106051 0.1838510), wk = 0.0013793 k( 612) = ( 0.5000000 0.5035075 0.1734743), wk = 0.0013793 k( 613) = ( 0.5000000 0.4964098 0.1630975), wk = 0.0013793 k( 614) = ( 0.5000000 0.4893122 0.1527208), wk = 0.0013793 k( 615) = ( 0.5000000 0.4822145 0.1423440), wk = 0.0013793 k( 616) = ( 0.5000000 0.4751168 0.1319673), wk = 0.0013793 k( 617) = ( 0.5000000 0.4680192 0.1215906), wk = 0.0013793 k( 618) = ( 0.5000000 0.4609215 0.1112138), wk = 0.0013793 k( 619) = ( 0.5000000 0.4538238 0.1008371), wk = 0.0013793 k( 620) = ( 0.5000000 0.4467262 0.0904603), wk = 0.0013793 k( 621) = ( 0.5000000 0.4396285 0.0800836), wk = 0.0013793 k( 622) = ( 0.5000000 0.4325308 0.0697068), wk = 0.0013793 k( 623) = ( 0.5000000 0.4254332 0.0593301), wk = 0.0013793 k( 624) = ( 0.5000000 0.4183355 0.0489533), wk = 0.0013793 k( 625) = ( 0.5000000 0.4112378 0.0385766), wk = 0.0013793 k( 626) = ( 0.5000000 0.4041402 0.0281998), wk = 0.0013793 k( 627) = ( 0.5000000 0.3970425 0.0178231), wk = 0.0013793 k( 628) = ( 0.5000000 0.3899448 0.0074463), wk = 0.0013793 k( 629) = ( 0.5000000 0.3828471 -0.0029304), wk = 0.0013793 k( 630) = ( 0.5000000 0.3757495 -0.0133072), wk = 0.0013793 k( 631) = ( 0.5000000 0.3686518 -0.0236839), wk = 0.0013793 k( 632) = ( 0.5000000 0.3615541 -0.0340607), wk = 0.0013793 k( 633) = ( 0.5000000 0.3544565 -0.0444374), wk = 0.0013793 k( 634) = ( 0.5000000 0.3473588 -0.0548141), wk = 0.0013793 k( 635) = ( 0.5000000 0.3402611 -0.0651909), wk = 0.0013793 k( 636) = ( 0.5000000 0.3331635 -0.0755676), wk = 0.0013793 k( 637) = ( 0.5000000 0.3260658 -0.0859444), wk = 0.0013793 k( 638) = ( 0.5000000 0.3189682 -0.0963211), wk = 0.0013793 k( 639) = ( 0.5000000 0.3118705 -0.1066979), wk = 0.0013793 k( 640) = ( 0.5000000 0.3047728 -0.1170746), wk = 0.0013793 k( 641) = ( 0.5000000 0.2976752 -0.1274514), wk = 0.0013793 k( 642) = ( 0.5000000 0.2905775 -0.1378281), wk = 0.0013793 k( 643) = ( 0.5000000 0.2834798 -0.1482048), wk = 0.0013793 k( 644) = ( 0.5000000 0.2763822 -0.1585816), wk = 0.0013793 k( 645) = ( 0.5000000 0.2692845 -0.1689583), wk = 0.0013793 k( 646) = ( 0.5000000 0.2621868 -0.1793351), wk = 0.0013793 k( 647) = ( 0.5000000 0.2621868 0.7990094), wk = 0.0013793 k( 648) = ( 0.4935897 0.2588254 0.7887657), wk = 0.0013793 k( 649) = ( 0.4871795 0.2554641 0.7785220), wk = 0.0013793 k( 650) = ( 0.4807692 0.2521027 0.7682783), wk = 0.0013793 k( 651) = ( 0.4743590 0.2487413 0.7580346), wk = 0.0013793 k( 652) = ( 0.4679487 0.2453800 0.7477909), wk = 0.0013793 k( 653) = ( 0.4615385 0.2420186 0.7375472), wk = 0.0013793 k( 654) = ( 0.4551282 0.2386572 0.7273035), wk = 0.0013793 k( 655) = ( 0.4487179 0.2352959 0.7170598), wk = 0.0013793 k( 656) = ( 0.4423077 0.2319345 0.7068160), wk = 0.0013793 k( 657) = ( 0.4358974 0.2285731 0.6965723), wk = 0.0013793 k( 658) = ( 0.4294872 0.2252118 0.6863286), wk = 0.0013793 k( 659) = ( 0.4230769 0.2218504 0.6760849), wk = 0.0013793 k( 660) = ( 0.4166667 0.2184890 0.6658412), wk = 0.0013793 k( 661) = ( 0.4102564 0.2151276 0.6555975), wk = 0.0013793 k( 662) = ( 0.4038462 0.2117663 0.6453538), wk = 0.0013793 k( 663) = ( 0.3974359 0.2084049 0.6351101), wk = 0.0013793 k( 664) = ( 0.3910256 0.2050435 0.6248664), wk = 0.0013793 k( 665) = ( 0.3846154 0.2016822 0.6146226), wk = 0.0013793 k( 666) = ( 0.3782051 0.1983208 0.6043789), wk = 0.0013793 k( 667) = ( 0.3717949 0.1949594 0.5941352), wk = 0.0013793 k( 668) = ( 0.3653846 0.1915981 0.5838915), wk = 0.0013793 k( 669) = ( 0.3589744 0.1882367 0.5736478), wk = 0.0013793 k( 670) = ( 0.3525641 0.1848753 0.5634041), wk = 0.0013793 k( 671) = ( 0.3461538 0.1815140 0.5531604), wk = 0.0013793 k( 672) = ( 0.3397436 0.1781526 0.5429167), wk = 0.0013793 k( 673) = ( 0.3333333 0.1747912 0.5326730), wk = 0.0013793 k( 674) = ( 0.3269231 0.1714298 0.5224292), wk = 0.0013793 k( 675) = ( 0.3205128 0.1680685 0.5121855), wk = 0.0013793 k( 676) = ( 0.3141026 0.1647071 0.5019418), wk = 0.0013793 k( 677) = ( 0.3076923 0.1613457 0.4916981), wk = 0.0013793 k( 678) = ( 0.3012821 0.1579844 0.4814544), wk = 0.0013793 k( 679) = ( 0.2948718 0.1546230 0.4712107), wk = 0.0013793 k( 680) = ( 0.2884615 0.1512616 0.4609670), wk = 0.0013793 k( 681) = ( 0.2820513 0.1479003 0.4507233), wk = 0.0013793 k( 682) = ( 0.2756410 0.1445389 0.4404796), wk = 0.0013793 k( 683) = ( 0.2692308 0.1411775 0.4302359), wk = 0.0013793 k( 684) = ( 0.2628205 0.1378161 0.4199921), wk = 0.0013793 k( 685) = ( 0.2564103 0.1344548 0.4097484), wk = 0.0013793 k( 686) = ( 0.2500000 0.1310934 0.3995047), wk = 0.0013793 k( 687) = ( 0.2435897 0.1277320 0.3892610), wk = 0.0013793 k( 688) = ( 0.2371795 0.1243707 0.3790173), wk = 0.0013793 k( 689) = ( 0.2307692 0.1210093 0.3687736), wk = 0.0013793 k( 690) = ( 0.2243590 0.1176479 0.3585299), wk = 0.0013793 k( 691) = ( 0.2179487 0.1142866 0.3482862), wk = 0.0013793 k( 692) = ( 0.2115385 0.1109252 0.3380425), wk = 0.0013793 k( 693) = ( 0.2051282 0.1075638 0.3277987), wk = 0.0013793 k( 694) = ( 0.1987180 0.1042025 0.3175550), wk = 0.0013793 k( 695) = ( 0.1923077 0.1008411 0.3073113), wk = 0.0013793 k( 696) = ( 0.1858974 0.0974797 0.2970676), wk = 0.0013793 k( 697) = ( 0.1794872 0.0941183 0.2868239), wk = 0.0013793 k( 698) = ( 0.1730769 0.0907570 0.2765802), wk = 0.0013793 k( 699) = ( 0.1666667 0.0873956 0.2663365), wk = 0.0013793 k( 700) = ( 0.1602564 0.0840342 0.2560928), wk = 0.0013793 k( 701) = ( 0.1538461 0.0806729 0.2458491), wk = 0.0013793 k( 702) = ( 0.1474359 0.0773115 0.2356053), wk = 0.0013793 k( 703) = ( 0.1410256 0.0739501 0.2253616), wk = 0.0013793 k( 704) = ( 0.1346154 0.0705888 0.2151179), wk = 0.0013793 k( 705) = ( 0.1282051 0.0672274 0.2048742), wk = 0.0013793 k( 706) = ( 0.1217949 0.0638660 0.1946305), wk = 0.0013793 k( 707) = ( 0.1153846 0.0605047 0.1843868), wk = 0.0013793 k( 708) = ( 0.1089744 0.0571433 0.1741431), wk = 0.0013793 k( 709) = ( 0.1025641 0.0537819 0.1638994), wk = 0.0013793 k( 710) = ( 0.0961538 0.0504205 0.1536557), wk = 0.0013793 k( 711) = ( 0.0897436 0.0470592 0.1434120), wk = 0.0013793 k( 712) = ( 0.0833333 0.0436978 0.1331682), wk = 0.0013793 k( 713) = ( 0.0769231 0.0403364 0.1229245), wk = 0.0013793 k( 714) = ( 0.0705128 0.0369751 0.1126808), wk = 0.0013793 k( 715) = ( 0.0641026 0.0336137 0.1024371), wk = 0.0013793 k( 716) = ( 0.0576923 0.0302523 0.0921934), wk = 0.0013793 k( 717) = ( 0.0512821 0.0268910 0.0819497), wk = 0.0013793 k( 718) = ( 0.0448718 0.0235296 0.0717060), wk = 0.0013793 k( 719) = ( 0.0384615 0.0201682 0.0614623), wk = 0.0013793 k( 720) = ( 0.0320513 0.0168068 0.0512186), wk = 0.0013793 k( 721) = ( 0.0256410 0.0134455 0.0409748), wk = 0.0013793 k( 722) = ( 0.0192308 0.0100841 0.0307311), wk = 0.0013793 k( 723) = ( 0.0128205 0.0067227 0.0204874), wk = 0.0013793 k( 724) = ( 0.0064103 0.0033614 0.0102437), wk = 0.0013793 k( 725) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0013793 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0013793 k( 2) = ( 0.0067568 -0.0000000 0.0067568), wk = 0.0013793 k( 3) = ( 0.0135135 -0.0000000 0.0135135), wk = 0.0013793 k( 4) = ( 0.0202703 -0.0000000 0.0202703), wk = 0.0013793 k( 5) = ( 0.0270270 -0.0000000 0.0270270), wk = 0.0013793 k( 6) = ( 0.0337838 -0.0000000 0.0337838), wk = 0.0013793 k( 7) = ( 0.0405405 -0.0000000 0.0405405), wk = 0.0013793 k( 8) = ( 0.0472973 0.0000000 0.0472973), wk = 0.0013793 k( 9) = ( 0.0540540 -0.0000000 0.0540540), wk = 0.0013793 k( 10) = ( 0.0608108 -0.0000000 0.0608108), wk = 0.0013793 k( 11) = ( 0.0675676 -0.0000000 0.0675676), wk = 0.0013793 k( 12) = ( 0.0743243 0.0000000 0.0743243), wk = 0.0013793 k( 13) = ( 0.0810811 -0.0000000 0.0810811), wk = 0.0013793 k( 14) = ( 0.0878378 0.0000000 0.0878378), wk = 0.0013793 k( 15) = ( 0.0945946 -0.0000000 0.0945946), wk = 0.0013793 k( 16) = ( 0.1013514 0.0000000 0.1013514), wk = 0.0013793 k( 17) = ( 0.1081081 -0.0000000 0.1081081), wk = 0.0013793 k( 18) = ( 0.1148649 -0.0000000 0.1148649), wk = 0.0013793 k( 19) = ( 0.1216216 -0.0000000 0.1216216), wk = 0.0013793 k( 20) = ( 0.1283784 -0.0000000 0.1283784), wk = 0.0013793 k( 21) = ( 0.1351351 -0.0000000 0.1351351), wk = 0.0013793 k( 22) = ( 0.1418919 -0.0000000 0.1418919), wk = 0.0013793 k( 23) = ( 0.1486486 -0.0000000 0.1486486), wk = 0.0013793 k( 24) = ( 0.1554054 -0.0000000 0.1554054), wk = 0.0013793 k( 25) = ( 0.1621622 -0.0000000 0.1621622), wk = 0.0013793 k( 26) = ( 0.1689189 -0.0000000 0.1689189), wk = 0.0013793 k( 27) = ( 0.1756757 0.0000000 0.1756757), wk = 0.0013793 k( 28) = ( 0.1824324 -0.0000000 0.1824324), wk = 0.0013793 k( 29) = ( 0.1891892 -0.0000000 0.1891892), wk = 0.0013793 k( 30) = ( 0.1959460 0.0000000 0.1959460), wk = 0.0013793 k( 31) = ( 0.2027027 0.0000000 0.2027027), wk = 0.0013793 k( 32) = ( 0.2094595 -0.0000000 0.2094595), wk = 0.0013793 k( 33) = ( 0.2162162 -0.0000000 0.2162162), wk = 0.0013793 k( 34) = ( 0.2229730 -0.0000000 0.2229730), wk = 0.0013793 k( 35) = ( 0.2297297 0.0000000 0.2297297), wk = 0.0013793 k( 36) = ( 0.2364865 0.0000000 0.2364865), wk = 0.0013793 k( 37) = ( 0.2432432 -0.0000000 0.2432432), wk = 0.0013793 k( 38) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0013793 k( 39) = ( 0.2567568 -0.0000000 0.2567568), wk = 0.0013793 k( 40) = ( 0.2635135 -0.0000000 0.2635135), wk = 0.0013793 k( 41) = ( 0.2702703 -0.0000000 0.2702703), wk = 0.0013793 k( 42) = ( 0.2770270 0.0000000 0.2770270), wk = 0.0013793 k( 43) = ( 0.2837838 -0.0000000 0.2837838), wk = 0.0013793 k( 44) = ( 0.2905405 -0.0000000 0.2905405), wk = 0.0013793 k( 45) = ( 0.2972973 -0.0000000 0.2972973), wk = 0.0013793 k( 46) = ( 0.3040541 0.0000000 0.3040541), wk = 0.0013793 k( 47) = ( 0.3108108 0.0000000 0.3108108), wk = 0.0013793 k( 48) = ( 0.3175676 0.0000000 0.3175676), wk = 0.0013793 k( 49) = ( 0.3243243 -0.0000000 0.3243243), wk = 0.0013793 k( 50) = ( 0.3310811 -0.0000000 0.3310811), wk = 0.0013793 k( 51) = ( 0.3378378 -0.0000000 0.3378378), wk = 0.0013793 k( 52) = ( 0.3445946 -0.0000000 0.3445946), wk = 0.0013793 k( 53) = ( 0.3513514 -0.0000000 0.3513513), wk = 0.0013793 k( 54) = ( 0.3581081 0.0000000 0.3581081), wk = 0.0013793 k( 55) = ( 0.3648649 -0.0000000 0.3648649), wk = 0.0013793 k( 56) = ( 0.3716216 -0.0000000 0.3716216), wk = 0.0013793 k( 57) = ( 0.3783784 -0.0000000 0.3783784), wk = 0.0013793 k( 58) = ( 0.3851351 0.0000000 0.3851351), wk = 0.0013793 k( 59) = ( 0.3918919 -0.0000000 0.3918919), wk = 0.0013793 k( 60) = ( 0.3986486 0.0000000 0.3986486), wk = 0.0013793 k( 61) = ( 0.4054054 0.0000000 0.4054054), wk = 0.0013793 k( 62) = ( 0.4121622 -0.0000000 0.4121622), wk = 0.0013793 k( 63) = ( 0.4189189 -0.0000000 0.4189189), wk = 0.0013793 k( 64) = ( 0.4256757 -0.0000000 0.4256757), wk = 0.0013793 k( 65) = ( 0.4324324 0.0000000 0.4324324), wk = 0.0013793 k( 66) = ( 0.4391892 0.0000000 0.4391892), wk = 0.0013793 k( 67) = ( 0.4459459 -0.0000000 0.4459459), wk = 0.0013793 k( 68) = ( 0.4527027 -0.0000000 0.4527027), wk = 0.0013793 k( 69) = ( 0.4594595 0.0000000 0.4594595), wk = 0.0013793 k( 70) = ( 0.4662162 0.0000000 0.4662162), wk = 0.0013793 k( 71) = ( 0.4729730 -0.0000000 0.4729730), wk = 0.0013793 k( 72) = ( 0.4797297 0.0000000 0.4797297), wk = 0.0013793 k( 73) = ( 0.4864865 -0.0000000 0.4864865), wk = 0.0013793 k( 74) = ( 0.4932432 -0.0000000 0.4932432), wk = 0.0013793 k( 75) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0013793 k( 76) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0013793 k( 77) = ( 0.5106383 0.0106383 0.5000000), wk = 0.0013793 k( 78) = ( 0.5212766 0.0212766 0.5000000), wk = 0.0013793 k( 79) = ( 0.5319149 0.0319149 0.5000000), wk = 0.0013793 k( 80) = ( 0.5425532 0.0425532 0.5000000), wk = 0.0013793 k( 81) = ( 0.5531915 0.0531915 0.5000000), wk = 0.0013793 k( 82) = ( 0.5638298 0.0638298 0.5000000), wk = 0.0013793 k( 83) = ( 0.5744681 0.0744681 0.5000000), wk = 0.0013793 k( 84) = ( 0.5851064 0.0851064 0.5000000), wk = 0.0013793 k( 85) = ( 0.5957447 0.0957447 0.5000000), wk = 0.0013793 k( 86) = ( 0.6063830 0.1063830 0.5000000), wk = 0.0013793 k( 87) = ( 0.6170213 0.1170213 0.5000000), wk = 0.0013793 k( 88) = ( 0.6276596 0.1276596 0.5000000), wk = 0.0013793 k( 89) = ( 0.6382979 0.1382979 0.5000000), wk = 0.0013793 k( 90) = ( 0.6489362 0.1489362 0.5000000), wk = 0.0013793 k( 91) = ( 0.6595745 0.1595745 0.5000000), wk = 0.0013793 k( 92) = ( 0.6702128 0.1702128 0.5000000), wk = 0.0013793 k( 93) = ( 0.6808511 0.1808511 0.5000000), wk = 0.0013793 k( 94) = ( 0.6914894 0.1914894 0.5000000), wk = 0.0013793 k( 95) = ( 0.7021277 0.2021277 0.5000000), wk = 0.0013793 k( 96) = ( 0.7127660 0.2127660 0.5000000), wk = 0.0013793 k( 97) = ( 0.7234043 0.2234043 0.5000000), wk = 0.0013793 k( 98) = ( 0.7340425 0.2340425 0.5000000), wk = 0.0013793 k( 99) = ( 0.7446808 0.2446808 0.5000000), wk = 0.0013793 k( 100) = ( 0.7553192 0.2553192 0.5000000), wk = 0.0013793 k( 101) = ( 0.7659575 0.2659574 0.5000000), wk = 0.0013793 k( 102) = ( 0.7765957 0.2765957 0.5000000), wk = 0.0013793 k( 103) = ( 0.7872340 0.2872340 0.5000000), wk = 0.0013793 k( 104) = ( 0.7978723 0.2978723 0.5000000), wk = 0.0013793 k( 105) = ( 0.8085106 0.3085106 0.5000000), wk = 0.0013793 k( 106) = ( 0.8191489 0.3191489 0.5000000), wk = 0.0013793 k( 107) = ( 0.8297872 0.3297872 0.5000000), wk = 0.0013793 k( 108) = ( 0.8404255 0.3404255 0.5000000), wk = 0.0013793 k( 109) = ( 0.8510638 0.3510638 0.5000000), wk = 0.0013793 k( 110) = ( 0.8617021 0.3617021 0.5000000), wk = 0.0013793 k( 111) = ( 0.8723404 0.3723404 0.5000000), wk = 0.0013793 k( 112) = ( 0.8829787 0.3829787 0.5000000), wk = 0.0013793 k( 113) = ( 0.8936170 0.3936170 0.5000000), wk = 0.0013793 k( 114) = ( 0.9042553 0.4042553 0.5000000), wk = 0.0013793 k( 115) = ( 0.9148936 0.4148936 0.5000000), wk = 0.0013793 k( 116) = ( 0.9255319 0.4255319 0.5000000), wk = 0.0013793 k( 117) = ( 0.9361702 0.4361702 0.5000000), wk = 0.0013793 k( 118) = ( 0.9468085 0.4468085 0.5000000), wk = 0.0013793 k( 119) = ( 0.9574468 0.4574468 0.5000000), wk = 0.0013793 k( 120) = ( 0.9680851 0.4680851 0.5000000), wk = 0.0013793 k( 121) = ( 0.9787234 0.4787234 0.5000000), wk = 0.0013793 k( 122) = ( 0.9893617 0.4893617 0.5000000), wk = 0.0013793 k( 123) = ( 1.0000000 0.5000000 0.5000000), wk = 0.0013793 k( 124) = ( 1.0000000 0.5000000 0.5000000), wk = 0.0013793 k( 125) = ( 0.9932432 0.5000000 0.4932432), wk = 0.0013793 k( 126) = ( 0.9864865 0.5000000 0.4864865), wk = 0.0013793 k( 127) = ( 0.9797297 0.5000000 0.4797297), wk = 0.0013793 k( 128) = ( 0.9729730 0.5000000 0.4729730), wk = 0.0013793 k( 129) = ( 0.9662162 0.5000000 0.4662162), wk = 0.0013793 k( 130) = ( 0.9594595 0.5000000 0.4594595), wk = 0.0013793 k( 131) = ( 0.9527027 0.5000000 0.4527027), wk = 0.0013793 k( 132) = ( 0.9459460 0.5000000 0.4459459), wk = 0.0013793 k( 133) = ( 0.9391892 0.5000000 0.4391892), wk = 0.0013793 k( 134) = ( 0.9324324 0.5000000 0.4324324), wk = 0.0013793 k( 135) = ( 0.9256757 0.5000000 0.4256757), wk = 0.0013793 k( 136) = ( 0.9189189 0.5000000 0.4189189), wk = 0.0013793 k( 137) = ( 0.9121622 0.5000000 0.4121622), wk = 0.0013793 k( 138) = ( 0.9054054 0.5000000 0.4054054), wk = 0.0013793 k( 139) = ( 0.8986487 0.5000000 0.3986486), wk = 0.0013793 k( 140) = ( 0.8918919 0.5000000 0.3918919), wk = 0.0013793 k( 141) = ( 0.8851351 0.5000000 0.3851351), wk = 0.0013793 k( 142) = ( 0.8783784 0.5000000 0.3783784), wk = 0.0013793 k( 143) = ( 0.8716216 0.5000000 0.3716216), wk = 0.0013793 k( 144) = ( 0.8648649 0.5000000 0.3648649), wk = 0.0013793 k( 145) = ( 0.8581081 0.5000000 0.3581081), wk = 0.0013793 k( 146) = ( 0.8513513 0.5000000 0.3513514), wk = 0.0013793 k( 147) = ( 0.8445946 0.5000000 0.3445946), wk = 0.0013793 k( 148) = ( 0.8378378 0.5000000 0.3378378), wk = 0.0013793 k( 149) = ( 0.8310811 0.5000000 0.3310811), wk = 0.0013793 k( 150) = ( 0.8243243 0.5000000 0.3243243), wk = 0.0013793 k( 151) = ( 0.8175676 0.5000000 0.3175676), wk = 0.0013793 k( 152) = ( 0.8108108 0.5000000 0.3108108), wk = 0.0013793 k( 153) = ( 0.8040540 0.5000000 0.3040541), wk = 0.0013793 k( 154) = ( 0.7972973 0.5000000 0.2972973), wk = 0.0013793 k( 155) = ( 0.7905405 0.5000000 0.2905405), wk = 0.0013793 k( 156) = ( 0.7837838 0.5000000 0.2837838), wk = 0.0013793 k( 157) = ( 0.7770270 0.5000000 0.2770270), wk = 0.0013793 k( 158) = ( 0.7702703 0.5000000 0.2702703), wk = 0.0013793 k( 159) = ( 0.7635135 0.5000000 0.2635135), wk = 0.0013793 k( 160) = ( 0.7567568 0.5000000 0.2567568), wk = 0.0013793 k( 161) = ( 0.7500000 0.5000000 0.2500000), wk = 0.0013793 k( 162) = ( 0.7432432 0.5000000 0.2432432), wk = 0.0013793 k( 163) = ( 0.7364865 0.5000000 0.2364865), wk = 0.0013793 k( 164) = ( 0.7297297 0.5000000 0.2297297), wk = 0.0013793 k( 165) = ( 0.7229730 0.5000000 0.2229730), wk = 0.0013793 k( 166) = ( 0.7162162 0.5000000 0.2162162), wk = 0.0013793 k( 167) = ( 0.7094595 0.5000000 0.2094595), wk = 0.0013793 k( 168) = ( 0.7027027 0.5000000 0.2027027), wk = 0.0013793 k( 169) = ( 0.6959460 0.5000000 0.1959460), wk = 0.0013793 k( 170) = ( 0.6891892 0.5000000 0.1891892), wk = 0.0013793 k( 171) = ( 0.6824324 0.5000000 0.1824324), wk = 0.0013793 k( 172) = ( 0.6756757 0.5000000 0.1756757), wk = 0.0013793 k( 173) = ( 0.6689189 0.5000000 0.1689189), wk = 0.0013793 k( 174) = ( 0.6621622 0.5000000 0.1621622), wk = 0.0013793 k( 175) = ( 0.6554054 0.5000000 0.1554054), wk = 0.0013793 k( 176) = ( 0.6486487 0.5000000 0.1486486), wk = 0.0013793 k( 177) = ( 0.6418919 0.5000000 0.1418919), wk = 0.0013793 k( 178) = ( 0.6351351 0.5000000 0.1351351), wk = 0.0013793 k( 179) = ( 0.6283784 0.5000000 0.1283784), wk = 0.0013793 k( 180) = ( 0.6216216 0.5000000 0.1216216), wk = 0.0013793 k( 181) = ( 0.6148649 0.5000000 0.1148649), wk = 0.0013793 k( 182) = ( 0.6081081 0.5000000 0.1081081), wk = 0.0013793 k( 183) = ( 0.6013513 0.5000000 0.1013513), wk = 0.0013793 k( 184) = ( 0.5945946 0.5000000 0.0945946), wk = 0.0013793 k( 185) = ( 0.5878378 0.5000000 0.0878378), wk = 0.0013793 k( 186) = ( 0.5810811 0.5000000 0.0810811), wk = 0.0013793 k( 187) = ( 0.5743243 0.5000000 0.0743243), wk = 0.0013793 k( 188) = ( 0.5675676 0.5000000 0.0675676), wk = 0.0013793 k( 189) = ( 0.5608108 0.5000000 0.0608108), wk = 0.0013793 k( 190) = ( 0.5540540 0.5000000 0.0540540), wk = 0.0013793 k( 191) = ( 0.5472973 0.5000000 0.0472973), wk = 0.0013793 k( 192) = ( 0.5405405 0.5000000 0.0405405), wk = 0.0013793 k( 193) = ( 0.5337838 0.5000000 0.0337838), wk = 0.0013793 k( 194) = ( 0.5270270 0.5000000 0.0270270), wk = 0.0013793 k( 195) = ( 0.5202703 0.5000000 0.0202703), wk = 0.0013793 k( 196) = ( 0.5135135 0.5000000 0.0135135), wk = 0.0013793 k( 197) = ( 0.5067568 0.5000000 0.0067568), wk = 0.0013793 k( 198) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0013793 k( 199) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0013793 k( 200) = ( 0.4893617 0.4893617 0.0000000), wk = 0.0013793 k( 201) = ( 0.4787234 0.4787234 -0.0000000), wk = 0.0013793 k( 202) = ( 0.4680851 0.4680851 -0.0000000), wk = 0.0013793 k( 203) = ( 0.4574468 0.4574468 0.0000000), wk = 0.0013793 k( 204) = ( 0.4468085 0.4468085 0.0000000), wk = 0.0013793 k( 205) = ( 0.4361702 0.4361702 -0.0000000), wk = 0.0013793 k( 206) = ( 0.4255319 0.4255319 -0.0000000), wk = 0.0013793 k( 207) = ( 0.4148936 0.4148936 0.0000000), wk = 0.0013793 k( 208) = ( 0.4042553 0.4042553 -0.0000000), wk = 0.0013793 k( 209) = ( 0.3936170 0.3936170 -0.0000000), wk = 0.0013793 k( 210) = ( 0.3829787 0.3829787 -0.0000000), wk = 0.0013793 k( 211) = ( 0.3723404 0.3723404 -0.0000000), wk = 0.0013793 k( 212) = ( 0.3617021 0.3617021 -0.0000000), wk = 0.0013793 k( 213) = ( 0.3510638 0.3510638 -0.0000000), wk = 0.0013793 k( 214) = ( 0.3404255 0.3404255 -0.0000000), wk = 0.0013793 k( 215) = ( 0.3297872 0.3297872 -0.0000000), wk = 0.0013793 k( 216) = ( 0.3191489 0.3191489 -0.0000000), wk = 0.0013793 k( 217) = ( 0.3085106 0.3085106 -0.0000000), wk = 0.0013793 k( 218) = ( 0.2978723 0.2978723 0.0000000), wk = 0.0013793 k( 219) = ( 0.2872340 0.2872340 -0.0000000), wk = 0.0013793 k( 220) = ( 0.2765957 0.2765957 -0.0000000), wk = 0.0013793 k( 221) = ( 0.2659574 0.2659574 -0.0000000), wk = 0.0013793 k( 222) = ( 0.2553191 0.2553191 -0.0000000), wk = 0.0013793 k( 223) = ( 0.2446809 0.2446808 0.0000000), wk = 0.0013793 k( 224) = ( 0.2340425 0.2340425 -0.0000000), wk = 0.0013793 k( 225) = ( 0.2234043 0.2234043 -0.0000000), wk = 0.0013793 k( 226) = ( 0.2127660 0.2127660 -0.0000000), wk = 0.0013793 k( 227) = ( 0.2021277 0.2021277 -0.0000000), wk = 0.0013793 k( 228) = ( 0.1914894 0.1914894 -0.0000000), wk = 0.0013793 k( 229) = ( 0.1808511 0.1808511 -0.0000000), wk = 0.0013793 k( 230) = ( 0.1702128 0.1702128 -0.0000000), wk = 0.0013793 k( 231) = ( 0.1595745 0.1595745 -0.0000000), wk = 0.0013793 k( 232) = ( 0.1489362 0.1489362 0.0000000), wk = 0.0013793 k( 233) = ( 0.1382979 0.1382979 -0.0000000), wk = 0.0013793 k( 234) = ( 0.1276596 0.1276596 -0.0000000), wk = 0.0013793 k( 235) = ( 0.1170213 0.1170213 0.0000000), wk = 0.0013793 k( 236) = ( 0.1063830 0.1063830 -0.0000000), wk = 0.0013793 k( 237) = ( 0.0957447 0.0957447 -0.0000000), wk = 0.0013793 k( 238) = ( 0.0851064 0.0851064 0.0000000), wk = 0.0013793 k( 239) = ( 0.0744681 0.0744681 -0.0000000), wk = 0.0013793 k( 240) = ( 0.0638298 0.0638298 -0.0000000), wk = 0.0013793 k( 241) = ( 0.0531915 0.0531915 -0.0000000), wk = 0.0013793 k( 242) = ( 0.0425532 0.0425532 0.0000000), wk = 0.0013793 k( 243) = ( 0.0319149 0.0319149 0.0000000), wk = 0.0013793 k( 244) = ( 0.0212766 0.0212766 -0.0000000), wk = 0.0013793 k( 245) = ( 0.0106383 0.0106383 -0.0000000), wk = 0.0013793 k( 246) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0013793 k( 247) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0013793 k( 248) = ( 0.0000000 0.0039039 0.0039039), wk = 0.0013793 k( 249) = ( 0.0000000 0.0078077 0.0078077), wk = 0.0013793 k( 250) = ( 0.0000000 0.0117116 0.0117116), wk = 0.0013793 k( 251) = ( 0.0000000 0.0156154 0.0156155), wk = 0.0013793 k( 252) = ( 0.0000000 0.0195193 0.0195193), wk = 0.0013793 k( 253) = ( 0.0000000 0.0234232 0.0234232), wk = 0.0013793 k( 254) = ( 0.0000000 0.0273270 0.0273270), wk = 0.0013793 k( 255) = ( 0.0000000 0.0312309 0.0312309), wk = 0.0013793 k( 256) = ( 0.0000000 0.0351348 0.0351348), wk = 0.0013793 k( 257) = ( 0.0000000 0.0390386 0.0390386), wk = 0.0013793 k( 258) = ( 0.0000000 0.0429425 0.0429425), wk = 0.0013793 k( 259) = ( 0.0000000 0.0468464 0.0468464), wk = 0.0013793 k( 260) = ( 0.0000000 0.0507502 0.0507502), wk = 0.0013793 k( 261) = ( 0.0000000 0.0546541 0.0546541), wk = 0.0013793 k( 262) = ( 0.0000000 0.0585579 0.0585579), wk = 0.0013793 k( 263) = ( 0.0000000 0.0624618 0.0624618), wk = 0.0013793 k( 264) = ( 0.0000000 0.0663657 0.0663657), wk = 0.0013793 k( 265) = ( 0.0000000 0.0702695 0.0702695), wk = 0.0013793 k( 266) = ( 0.0000000 0.0741734 0.0741734), wk = 0.0013793 k( 267) = ( 0.0000000 0.0780773 0.0780773), wk = 0.0013793 k( 268) = ( 0.0000000 0.0819811 0.0819811), wk = 0.0013793 k( 269) = ( 0.0000000 0.0858850 0.0858850), wk = 0.0013793 k( 270) = ( 0.0000000 0.0897888 0.0897888), wk = 0.0013793 k( 271) = ( 0.0000000 0.0936927 0.0936927), wk = 0.0013793 k( 272) = ( 0.0000000 0.0975966 0.0975966), wk = 0.0013793 k( 273) = ( 0.0000000 0.1015004 0.1015004), wk = 0.0013793 k( 274) = ( 0.0000000 0.1054043 0.1054043), wk = 0.0013793 k( 275) = ( 0.0000000 0.1093082 0.1093082), wk = 0.0013793 k( 276) = ( 0.0000000 0.1132120 0.1132120), wk = 0.0013793 k( 277) = ( 0.0000000 0.1171159 0.1171159), wk = 0.0013793 k( 278) = ( 0.0000000 0.1210197 0.1210197), wk = 0.0013793 k( 279) = ( 0.0000000 0.1249236 0.1249236), wk = 0.0013793 k( 280) = ( 0.0000000 0.1288275 0.1288275), wk = 0.0013793 k( 281) = ( 0.0000000 0.1327313 0.1327313), wk = 0.0013793 k( 282) = ( 0.0000000 0.1366352 0.1366352), wk = 0.0013793 k( 283) = ( 0.0000000 0.1405391 0.1405391), wk = 0.0013793 k( 284) = ( 0.0000000 0.1444429 0.1444429), wk = 0.0013793 k( 285) = ( 0.0000000 0.1483468 0.1483468), wk = 0.0013793 k( 286) = ( 0.0000000 0.1522506 0.1522506), wk = 0.0013793 k( 287) = ( 0.0000000 0.1561545 0.1561545), wk = 0.0013793 k( 288) = ( 0.0000000 0.1600584 0.1600584), wk = 0.0013793 k( 289) = ( 0.0000000 0.1639622 0.1639622), wk = 0.0013793 k( 290) = ( 0.0000000 0.1678661 0.1678661), wk = 0.0013793 k( 291) = ( 0.0000000 0.1717700 0.1717700), wk = 0.0013793 k( 292) = ( 0.0000000 0.1756738 0.1756738), wk = 0.0013793 k( 293) = ( 0.0000000 0.1795777 0.1795777), wk = 0.0013793 k( 294) = ( 0.0000000 0.1834815 0.1834815), wk = 0.0013793 k( 295) = ( 0.0000000 0.1873854 0.1873854), wk = 0.0013793 k( 296) = ( 0.0000000 0.1912893 0.1912893), wk = 0.0013793 k( 297) = ( 0.0000000 0.1951931 0.1951931), wk = 0.0013793 k( 298) = ( 0.0000000 0.1990970 0.1990970), wk = 0.0013793 k( 299) = ( 0.0000000 0.2030009 0.2030009), wk = 0.0013793 k( 300) = ( 0.0000000 0.2069047 0.2069047), wk = 0.0013793 k( 301) = ( 0.0000000 0.2108086 0.2108086), wk = 0.0013793 k( 302) = ( 0.0000000 0.2147124 0.2147124), wk = 0.0013793 k( 303) = ( 0.0000000 0.2186163 0.2186163), wk = 0.0013793 k( 304) = ( 0.0000000 0.2225202 0.2225202), wk = 0.0013793 k( 305) = ( 0.0000000 0.2264240 0.2264240), wk = 0.0013793 k( 306) = ( 0.0000000 0.2303279 0.2303279), wk = 0.0013793 k( 307) = ( 0.0000000 0.2342318 0.2342318), wk = 0.0013793 k( 308) = ( 0.0000000 0.2381356 0.2381356), wk = 0.0013793 k( 309) = ( 0.0000000 0.2420395 0.2420395), wk = 0.0013793 k( 310) = ( 0.0000000 0.2459434 0.2459434), wk = 0.0013793 k( 311) = ( 0.0000000 0.2498472 0.2498472), wk = 0.0013793 k( 312) = ( 0.0000000 0.2537511 0.2537511), wk = 0.0013793 k( 313) = ( 0.0000000 0.2576549 0.2576549), wk = 0.0013793 k( 314) = ( 0.0000000 0.2615588 0.2615588), wk = 0.0013793 k( 315) = ( 0.0000000 0.2654627 0.2654627), wk = 0.0013793 k( 316) = ( 0.0000000 0.2693665 0.2693665), wk = 0.0013793 k( 317) = ( 0.0000000 0.2732704 0.2732704), wk = 0.0013793 k( 318) = ( 0.0000000 0.2771743 0.2771743), wk = 0.0013793 k( 319) = ( 0.0000000 0.2810781 0.2810781), wk = 0.0013793 k( 320) = ( 0.0000000 0.2849820 0.2849820), wk = 0.0013793 k( 321) = ( 0.0000000 0.2888858 0.2888858), wk = 0.0013793 k( 322) = ( 0.0000000 0.2927897 0.2927897), wk = 0.0013793 k( 323) = ( 0.0000000 0.2966936 0.2966936), wk = 0.0013793 k( 324) = ( 0.0000000 0.3005974 0.3005974), wk = 0.0013793 k( 325) = ( 0.0000000 0.3045013 0.3045013), wk = 0.0013793 k( 326) = ( 0.0000000 0.3084052 0.3084051), wk = 0.0013793 k( 327) = ( 0.0000000 0.3123090 0.3123090), wk = 0.0013793 k( 328) = ( 0.0000000 0.3162129 0.3162129), wk = 0.0013793 k( 329) = ( 0.0000000 0.3201167 0.3201167), wk = 0.0013793 k( 330) = ( 0.0000000 0.3240206 0.3240206), wk = 0.0013793 k( 331) = ( 0.0000000 0.3279245 0.3279245), wk = 0.0013793 k( 332) = ( 0.0000000 0.3318283 0.3318283), wk = 0.0013793 k( 333) = ( 0.0000000 0.3357322 0.3357322), wk = 0.0013793 k( 334) = ( 0.0000000 0.3396361 0.3396360), wk = 0.0013793 k( 335) = ( 0.0000000 0.3435399 0.3435399), wk = 0.0013793 k( 336) = ( 0.0000000 0.3474438 0.3474438), wk = 0.0013793 k( 337) = ( 0.0000000 0.3513476 0.3513476), wk = 0.0013793 k( 338) = ( 0.0000000 0.3552515 0.3552515), wk = 0.0013793 k( 339) = ( 0.0000000 0.3591554 0.3591554), wk = 0.0013793 k( 340) = ( 0.0000000 0.3630592 0.3630592), wk = 0.0013793 k( 341) = ( 0.0000000 0.3669631 0.3669631), wk = 0.0013793 k( 342) = ( 0.0000000 0.3669631 0.3669631), wk = 0.0013793 k( 343) = ( 0.0058140 0.3650252 0.3708391), wk = 0.0013793 k( 344) = ( 0.0116279 0.3630873 0.3747152), wk = 0.0013793 k( 345) = ( 0.0174419 0.3611494 0.3785912), wk = 0.0013793 k( 346) = ( 0.0232558 0.3592115 0.3824673), wk = 0.0013793 k( 347) = ( 0.0290698 0.3572735 0.3863433), wk = 0.0013793 k( 348) = ( 0.0348837 0.3553356 0.3902194), wk = 0.0013793 k( 349) = ( 0.0406977 0.3533977 0.3940954), wk = 0.0013793 k( 350) = ( 0.0465116 0.3514598 0.3979715), wk = 0.0013793 k( 351) = ( 0.0523256 0.3495219 0.4018475), wk = 0.0013793 k( 352) = ( 0.0581395 0.3475840 0.4057235), wk = 0.0013793 k( 353) = ( 0.0639535 0.3456461 0.4095996), wk = 0.0013793 k( 354) = ( 0.0697674 0.3437082 0.4134756), wk = 0.0013793 k( 355) = ( 0.0755814 0.3417703 0.4173517), wk = 0.0013793 k( 356) = ( 0.0813954 0.3398324 0.4212277), wk = 0.0013793 k( 357) = ( 0.0872093 0.3378945 0.4251038), wk = 0.0013793 k( 358) = ( 0.0930233 0.3359566 0.4289798), wk = 0.0013793 k( 359) = ( 0.0988372 0.3340186 0.4328558), wk = 0.0013793 k( 360) = ( 0.1046512 0.3320807 0.4367319), wk = 0.0013793 k( 361) = ( 0.1104651 0.3301428 0.4406079), wk = 0.0013793 k( 362) = ( 0.1162791 0.3282049 0.4444840), wk = 0.0013793 k( 363) = ( 0.1220930 0.3262670 0.4483600), wk = 0.0013793 k( 364) = ( 0.1279070 0.3243291 0.4522361), wk = 0.0013793 k( 365) = ( 0.1337209 0.3223912 0.4561121), wk = 0.0013793 k( 366) = ( 0.1395349 0.3204533 0.4599882), wk = 0.0013793 k( 367) = ( 0.1453488 0.3185154 0.4638642), wk = 0.0013793 k( 368) = ( 0.1511628 0.3165775 0.4677403), wk = 0.0013793 k( 369) = ( 0.1569767 0.3146396 0.4716163), wk = 0.0013793 k( 370) = ( 0.1627907 0.3127016 0.4754924), wk = 0.0013793 k( 371) = ( 0.1686046 0.3107637 0.4793684), wk = 0.0013793 k( 372) = ( 0.1744186 0.3088258 0.4832444), wk = 0.0013793 k( 373) = ( 0.1802326 0.3068879 0.4871205), wk = 0.0013793 k( 374) = ( 0.1860465 0.3049500 0.4909965), wk = 0.0013793 k( 375) = ( 0.1918605 0.3030121 0.4948726), wk = 0.0013793 k( 376) = ( 0.1976744 0.3010742 0.4987486), wk = 0.0013793 k( 377) = ( 0.2034884 0.2991363 0.5026247), wk = 0.0013793 k( 378) = ( 0.2093023 0.2971984 0.5065007), wk = 0.0013793 k( 379) = ( 0.2151163 0.2952605 0.5103768), wk = 0.0013793 k( 380) = ( 0.2209302 0.2933226 0.5142528), wk = 0.0013793 k( 381) = ( 0.2267442 0.2913847 0.5181288), wk = 0.0013793 k( 382) = ( 0.2325581 0.2894467 0.5220049), wk = 0.0013793 k( 383) = ( 0.2383721 0.2875088 0.5258809), wk = 0.0013793 k( 384) = ( 0.2441860 0.2855709 0.5297570), wk = 0.0013793 k( 385) = ( 0.2500000 0.2836330 0.5336330), wk = 0.0013793 k( 386) = ( 0.2558140 0.2816951 0.5375091), wk = 0.0013793 k( 387) = ( 0.2616279 0.2797572 0.5413851), wk = 0.0013793 k( 388) = ( 0.2674419 0.2778193 0.5452611), wk = 0.0013793 k( 389) = ( 0.2732558 0.2758814 0.5491372), wk = 0.0013793 k( 390) = ( 0.2790698 0.2739435 0.5530132), wk = 0.0013793 k( 391) = ( 0.2848837 0.2720056 0.5568893), wk = 0.0013793 k( 392) = ( 0.2906977 0.2700677 0.5607653), wk = 0.0013793 k( 393) = ( 0.2965116 0.2681298 0.5646414), wk = 0.0013793 k( 394) = ( 0.3023256 0.2661918 0.5685174), wk = 0.0013793 k( 395) = ( 0.3081395 0.2642539 0.5723935), wk = 0.0013793 k( 396) = ( 0.3139535 0.2623160 0.5762695), wk = 0.0013793 k( 397) = ( 0.3197674 0.2603781 0.5801456), wk = 0.0013793 k( 398) = ( 0.3255814 0.2584402 0.5840216), wk = 0.0013793 k( 399) = ( 0.3313953 0.2565023 0.5878977), wk = 0.0013793 k( 400) = ( 0.3372093 0.2545644 0.5917737), wk = 0.0013793 k( 401) = ( 0.3430233 0.2526265 0.5956497), wk = 0.0013793 k( 402) = ( 0.3488372 0.2506886 0.5995258), wk = 0.0013793 k( 403) = ( 0.3546512 0.2487507 0.6034018), wk = 0.0013793 k( 404) = ( 0.3604651 0.2468127 0.6072779), wk = 0.0013793 k( 405) = ( 0.3662791 0.2448748 0.6111539), wk = 0.0013793 k( 406) = ( 0.3720930 0.2429369 0.6150300), wk = 0.0013793 k( 407) = ( 0.3779070 0.2409990 0.6189060), wk = 0.0013793 k( 408) = ( 0.3837209 0.2390611 0.6227820), wk = 0.0013793 k( 409) = ( 0.3895349 0.2371232 0.6266581), wk = 0.0013793 k( 410) = ( 0.3953488 0.2351853 0.6305341), wk = 0.0013793 k( 411) = ( 0.4011628 0.2332474 0.6344102), wk = 0.0013793 k( 412) = ( 0.4069767 0.2313095 0.6382862), wk = 0.0013793 k( 413) = ( 0.4127907 0.2293716 0.6421623), wk = 0.0013793 k( 414) = ( 0.4186047 0.2274337 0.6460383), wk = 0.0013793 k( 415) = ( 0.4244186 0.2254958 0.6499144), wk = 0.0013793 k( 416) = ( 0.4302326 0.2235579 0.6537904), wk = 0.0013793 k( 417) = ( 0.4360465 0.2216199 0.6576665), wk = 0.0013793 k( 418) = ( 0.4418605 0.2196820 0.6615425), wk = 0.0013793 k( 419) = ( 0.4476744 0.2177441 0.6654185), wk = 0.0013793 k( 420) = ( 0.4534884 0.2158062 0.6692946), wk = 0.0013793 k( 421) = ( 0.4593023 0.2138683 0.6731706), wk = 0.0013793 k( 422) = ( 0.4651163 0.2119304 0.6770467), wk = 0.0013793 k( 423) = ( 0.4709302 0.2099925 0.6809227), wk = 0.0013793 k( 424) = ( 0.4767442 0.2080546 0.6847988), wk = 0.0013793 k( 425) = ( 0.4825581 0.2061167 0.6886748), wk = 0.0013793 k( 426) = ( 0.4883721 0.2041788 0.6925509), wk = 0.0013793 k( 427) = ( 0.4941860 0.2022408 0.6964269), wk = 0.0013793 k( 428) = ( 0.5000000 0.2003030 0.7003029), wk = 0.0013793 k( 429) = ( 0.5000000 0.2003030 0.7003029), wk = 0.0013793 k( 430) = ( 0.5000000 0.1964510 0.6964510), wk = 0.0013793 k( 431) = ( 0.5000000 0.1925990 0.6925990), wk = 0.0013793 k( 432) = ( 0.5000000 0.1887470 0.6887470), wk = 0.0013793 k( 433) = ( 0.5000000 0.1848950 0.6848950), wk = 0.0013793 k( 434) = ( 0.5000000 0.1810430 0.6810430), wk = 0.0013793 k( 435) = ( 0.5000000 0.1771911 0.6771911), wk = 0.0013793 k( 436) = ( 0.5000000 0.1733391 0.6733391), wk = 0.0013793 k( 437) = ( 0.5000000 0.1694871 0.6694871), wk = 0.0013793 k( 438) = ( 0.5000000 0.1656351 0.6656351), wk = 0.0013793 k( 439) = ( 0.5000000 0.1617831 0.6617831), wk = 0.0013793 k( 440) = ( 0.5000000 0.1579312 0.6579312), wk = 0.0013793 k( 441) = ( 0.5000000 0.1540792 0.6540792), wk = 0.0013793 k( 442) = ( 0.5000000 0.1502272 0.6502272), wk = 0.0013793 k( 443) = ( 0.5000000 0.1463752 0.6463752), wk = 0.0013793 k( 444) = ( 0.5000000 0.1425232 0.6425232), wk = 0.0013793 k( 445) = ( 0.5000000 0.1386713 0.6386713), wk = 0.0013793 k( 446) = ( 0.5000000 0.1348193 0.6348193), wk = 0.0013793 k( 447) = ( 0.5000000 0.1309673 0.6309673), wk = 0.0013793 k( 448) = ( 0.5000000 0.1271153 0.6271153), wk = 0.0013793 k( 449) = ( 0.5000000 0.1232633 0.6232633), wk = 0.0013793 k( 450) = ( 0.5000000 0.1194114 0.6194114), wk = 0.0013793 k( 451) = ( 0.5000000 0.1155594 0.6155594), wk = 0.0013793 k( 452) = ( 0.5000000 0.1117074 0.6117074), wk = 0.0013793 k( 453) = ( 0.5000000 0.1078554 0.6078554), wk = 0.0013793 k( 454) = ( 0.5000000 0.1040034 0.6040034), wk = 0.0013793 k( 455) = ( 0.5000000 0.1001515 0.6001515), wk = 0.0013793 k( 456) = ( 0.5000000 0.0962995 0.5962995), wk = 0.0013793 k( 457) = ( 0.5000000 0.0924475 0.5924475), wk = 0.0013793 k( 458) = ( 0.5000000 0.0885955 0.5885955), wk = 0.0013793 k( 459) = ( 0.5000000 0.0847436 0.5847436), wk = 0.0013793 k( 460) = ( 0.5000000 0.0808916 0.5808916), wk = 0.0013793 k( 461) = ( 0.5000000 0.0770396 0.5770396), wk = 0.0013793 k( 462) = ( 0.5000000 0.0731876 0.5731876), wk = 0.0013793 k( 463) = ( 0.5000000 0.0693356 0.5693356), wk = 0.0013793 k( 464) = ( 0.5000000 0.0654837 0.5654837), wk = 0.0013793 k( 465) = ( 0.5000000 0.0616317 0.5616317), wk = 0.0013793 k( 466) = ( 0.5000000 0.0577797 0.5577797), wk = 0.0013793 k( 467) = ( 0.5000000 0.0539277 0.5539277), wk = 0.0013793 k( 468) = ( 0.5000000 0.0500757 0.5500757), wk = 0.0013793 k( 469) = ( 0.5000000 0.0462238 0.5462238), wk = 0.0013793 k( 470) = ( 0.5000000 0.0423718 0.5423718), wk = 0.0013793 k( 471) = ( 0.5000000 0.0385198 0.5385198), wk = 0.0013793 k( 472) = ( 0.5000000 0.0346678 0.5346678), wk = 0.0013793 k( 473) = ( 0.5000000 0.0308158 0.5308158), wk = 0.0013793 k( 474) = ( 0.5000000 0.0269639 0.5269639), wk = 0.0013793 k( 475) = ( 0.5000000 0.0231119 0.5231119), wk = 0.0013793 k( 476) = ( 0.5000000 0.0192599 0.5192599), wk = 0.0013793 k( 477) = ( 0.5000000 0.0154079 0.5154079), wk = 0.0013793 k( 478) = ( 0.5000000 0.0115559 0.5115559), wk = 0.0013793 k( 479) = ( 0.5000000 0.0077040 0.5077040), wk = 0.0013793 k( 480) = ( 0.5000000 0.0038520 0.5038520), wk = 0.0013793 k( 481) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0013793 k( 482) = ( 1.0000000 0.5000000 0.5000000), wk = 0.0013793 k( 483) = ( 1.0000000 0.5038010 0.5038010), wk = 0.0013793 k( 484) = ( 1.0000000 0.5076021 0.5076021), wk = 0.0013793 k( 485) = ( 1.0000000 0.5114032 0.5114032), wk = 0.0013793 k( 486) = ( 1.0000000 0.5152042 0.5152042), wk = 0.0013793 k( 487) = ( 1.0000000 0.5190053 0.5190053), wk = 0.0013793 k( 488) = ( 1.0000000 0.5228063 0.5228063), wk = 0.0013793 k( 489) = ( 1.0000000 0.5266074 0.5266074), wk = 0.0013793 k( 490) = ( 1.0000000 0.5304084 0.5304084), wk = 0.0013793 k( 491) = ( 1.0000000 0.5342095 0.5342095), wk = 0.0013793 k( 492) = ( 1.0000000 0.5380105 0.5380105), wk = 0.0013793 k( 493) = ( 1.0000000 0.5418116 0.5418116), wk = 0.0013793 k( 494) = ( 1.0000000 0.5456127 0.5456126), wk = 0.0013793 k( 495) = ( 1.0000000 0.5494137 0.5494137), wk = 0.0013793 k( 496) = ( 1.0000000 0.5532148 0.5532148), wk = 0.0013793 k( 497) = ( 1.0000000 0.5570158 0.5570158), wk = 0.0013793 k( 498) = ( 1.0000000 0.5608169 0.5608169), wk = 0.0013793 k( 499) = ( 1.0000000 0.5646179 0.5646179), wk = 0.0013793 k( 500) = ( 1.0000000 0.5684190 0.5684190), wk = 0.0013793 k( 501) = ( 1.0000000 0.5722200 0.5722200), wk = 0.0013793 k( 502) = ( 1.0000000 0.5760211 0.5760211), wk = 0.0013793 k( 503) = ( 1.0000000 0.5798221 0.5798222), wk = 0.0013793 k( 504) = ( 1.0000000 0.5836232 0.5836232), wk = 0.0013793 k( 505) = ( 1.0000000 0.5874242 0.5874242), wk = 0.0013793 k( 506) = ( 1.0000000 0.5912253 0.5912253), wk = 0.0013793 k( 507) = ( 1.0000000 0.5950264 0.5950264), wk = 0.0013793 k( 508) = ( 1.0000000 0.5988274 0.5988274), wk = 0.0013793 k( 509) = ( 1.0000000 0.6026285 0.6026285), wk = 0.0013793 k( 510) = ( 1.0000000 0.6064295 0.6064295), wk = 0.0013793 k( 511) = ( 1.0000000 0.6102306 0.6102306), wk = 0.0013793 k( 512) = ( 1.0000000 0.6140316 0.6140316), wk = 0.0013793 k( 513) = ( 1.0000000 0.6178327 0.6178327), wk = 0.0013793 k( 514) = ( 1.0000000 0.6216337 0.6216337), wk = 0.0013793 k( 515) = ( 1.0000000 0.6254348 0.6254348), wk = 0.0013793 k( 516) = ( 1.0000000 0.6292359 0.6292359), wk = 0.0013793 k( 517) = ( 1.0000000 0.6330369 0.6330369), wk = 0.0013793 k( 518) = ( 0.0000000 0.3669631 0.3669631), wk = 0.0013793 k( 519) = ( 0.0100000 0.3756178 0.3656178), wk = 0.0013793 k( 520) = ( 0.0200000 0.3842724 0.3642725), wk = 0.0013793 k( 521) = ( 0.0300000 0.3929271 0.3629271), wk = 0.0013793 k( 522) = ( 0.0400000 0.4015818 0.3615818), wk = 0.0013793 k( 523) = ( 0.0500000 0.4102365 0.3602365), wk = 0.0013793 k( 524) = ( 0.0600000 0.4188912 0.3588912), wk = 0.0013793 k( 525) = ( 0.0700000 0.4275459 0.3575458), wk = 0.0013793 k( 526) = ( 0.0800000 0.4362005 0.3562005), wk = 0.0013793 k( 527) = ( 0.0900000 0.4448552 0.3548552), wk = 0.0013793 k( 528) = ( 0.1000000 0.4535099 0.3535099), wk = 0.0013793 k( 529) = ( 0.1100000 0.4621646 0.3521646), wk = 0.0013793 k( 530) = ( 0.1200000 0.4708192 0.3508192), wk = 0.0013793 k( 531) = ( 0.1300000 0.4794739 0.3494739), wk = 0.0013793 k( 532) = ( 0.1400000 0.4881286 0.3481286), wk = 0.0013793 k( 533) = ( 0.1500000 0.4967833 0.3467833), wk = 0.0013793 k( 534) = ( 0.1600000 0.5054380 0.3454380), wk = 0.0013793 k( 535) = ( 0.1700000 0.5140926 0.3440926), wk = 0.0013793 k( 536) = ( 0.1800000 0.5227473 0.3427473), wk = 0.0013793 k( 537) = ( 0.1900000 0.5314020 0.3414020), wk = 0.0013793 k( 538) = ( 0.2000000 0.5400567 0.3400567), wk = 0.0013793 k( 539) = ( 0.2100000 0.5487114 0.3387114), wk = 0.0013793 k( 540) = ( 0.2200000 0.5573660 0.3373660), wk = 0.0013793 k( 541) = ( 0.2300000 0.5660207 0.3360207), wk = 0.0013793 k( 542) = ( 0.2400000 0.5746754 0.3346754), wk = 0.0013793 k( 543) = ( 0.2500000 0.5833301 0.3333301), wk = 0.0013793 k( 544) = ( 0.2600000 0.5919847 0.3319847), wk = 0.0013793 k( 545) = ( 0.2700000 0.6006394 0.3306394), wk = 0.0013793 k( 546) = ( 0.2800000 0.6092941 0.3292941), wk = 0.0013793 k( 547) = ( 0.2900000 0.6179488 0.3279488), wk = 0.0013793 k( 548) = ( 0.3000000 0.6266035 0.3266035), wk = 0.0013793 k( 549) = ( 0.3100000 0.6352581 0.3252582), wk = 0.0013793 k( 550) = ( 0.3200000 0.6439128 0.3239128), wk = 0.0013793 k( 551) = ( 0.3300000 0.6525675 0.3225675), wk = 0.0013793 k( 552) = ( 0.3400000 0.6612222 0.3212222), wk = 0.0013793 k( 553) = ( 0.3500000 0.6698769 0.3198769), wk = 0.0013793 k( 554) = ( 0.3600000 0.6785315 0.3185315), wk = 0.0013793 k( 555) = ( 0.3700000 0.6871862 0.3171862), wk = 0.0013793 k( 556) = ( 0.3800000 0.6958409 0.3158409), wk = 0.0013793 k( 557) = ( 0.3900000 0.7044956 0.3144956), wk = 0.0013793 k( 558) = ( 0.4000000 0.7131503 0.3131503), wk = 0.0013793 k( 559) = ( 0.4100000 0.7218049 0.3118049), wk = 0.0013793 k( 560) = ( 0.4200000 0.7304596 0.3104596), wk = 0.0013793 k( 561) = ( 0.4300000 0.7391143 0.3091143), wk = 0.0013793 k( 562) = ( 0.4400000 0.7477690 0.3077690), wk = 0.0013793 k( 563) = ( 0.4500000 0.7564237 0.3064237), wk = 0.0013793 k( 564) = ( 0.4600000 0.7650783 0.3050783), wk = 0.0013793 k( 565) = ( 0.4700000 0.7737330 0.3037330), wk = 0.0013793 k( 566) = ( 0.4800000 0.7823877 0.3023877), wk = 0.0013793 k( 567) = ( 0.4900000 0.7910424 0.3010424), wk = 0.0013793 k( 568) = ( 0.5000000 0.7996971 0.2996971), wk = 0.0013793 k( 569) = ( 0.5000000 0.7996971 0.2996971), wk = 0.0013793 k( 570) = ( 0.5000000 0.7958049 0.2958049), wk = 0.0013793 k( 571) = ( 0.5000000 0.7919127 0.2919127), wk = 0.0013793 k( 572) = ( 0.5000000 0.7880205 0.2880205), wk = 0.0013793 k( 573) = ( 0.5000000 0.7841284 0.2841284), wk = 0.0013793 k( 574) = ( 0.5000000 0.7802362 0.2802362), wk = 0.0013793 k( 575) = ( 0.5000000 0.7763440 0.2763440), wk = 0.0013793 k( 576) = ( 0.5000000 0.7724519 0.2724519), wk = 0.0013793 k( 577) = ( 0.5000000 0.7685597 0.2685597), wk = 0.0013793 k( 578) = ( 0.5000000 0.7646675 0.2646675), wk = 0.0013793 k( 579) = ( 0.5000000 0.7607754 0.2607754), wk = 0.0013793 k( 580) = ( 0.5000000 0.7568832 0.2568832), wk = 0.0013793 k( 581) = ( 0.5000000 0.7529910 0.2529910), wk = 0.0013793 k( 582) = ( 0.5000000 0.7490988 0.2490989), wk = 0.0013793 k( 583) = ( 0.5000000 0.7452067 0.2452067), wk = 0.0013793 k( 584) = ( 0.5000000 0.7413145 0.2413145), wk = 0.0013793 k( 585) = ( 0.5000000 0.7374223 0.2374223), wk = 0.0013793 k( 586) = ( 0.5000000 0.7335302 0.2335302), wk = 0.0013793 k( 587) = ( 0.5000000 0.7296380 0.2296380), wk = 0.0013793 k( 588) = ( 0.5000000 0.7257458 0.2257458), wk = 0.0013793 k( 589) = ( 0.5000000 0.7218537 0.2218537), wk = 0.0013793 k( 590) = ( 0.5000000 0.7179615 0.2179615), wk = 0.0013793 k( 591) = ( 0.5000000 0.7140693 0.2140693), wk = 0.0013793 k( 592) = ( 0.5000000 0.7101772 0.2101772), wk = 0.0013793 k( 593) = ( 0.5000000 0.7062850 0.2062850), wk = 0.0013793 k( 594) = ( 0.5000000 0.7023928 0.2023928), wk = 0.0013793 k( 595) = ( 0.5000000 0.6985006 0.1985007), wk = 0.0013793 k( 596) = ( 0.5000000 0.6946085 0.1946085), wk = 0.0013793 k( 597) = ( 0.5000000 0.6907163 0.1907163), wk = 0.0013793 k( 598) = ( 0.5000000 0.6868241 0.1868241), wk = 0.0013793 k( 599) = ( 0.5000000 0.6829320 0.1829320), wk = 0.0013793 k( 600) = ( 0.5000000 0.6790398 0.1790398), wk = 0.0013793 k( 601) = ( 0.5000000 0.6751476 0.1751476), wk = 0.0013793 k( 602) = ( 0.5000000 0.6712555 0.1712555), wk = 0.0013793 k( 603) = ( 0.5000000 0.6673633 0.1673633), wk = 0.0013793 k( 604) = ( 0.5000000 0.6634711 0.1634711), wk = 0.0013793 k( 605) = ( 0.5000000 0.6595789 0.1595789), wk = 0.0013793 k( 606) = ( 0.5000000 0.6556868 0.1556868), wk = 0.0013793 k( 607) = ( 0.5000000 0.6517946 0.1517946), wk = 0.0013793 k( 608) = ( 0.5000000 0.6479024 0.1479024), wk = 0.0013793 k( 609) = ( 0.5000000 0.6440103 0.1440103), wk = 0.0013793 k( 610) = ( 0.5000000 0.6401181 0.1401181), wk = 0.0013793 k( 611) = ( 0.5000000 0.6362259 0.1362259), wk = 0.0013793 k( 612) = ( 0.5000000 0.6323338 0.1323338), wk = 0.0013793 k( 613) = ( 0.5000000 0.6284416 0.1284416), wk = 0.0013793 k( 614) = ( 0.5000000 0.6245494 0.1245494), wk = 0.0013793 k( 615) = ( 0.5000000 0.6206573 0.1206573), wk = 0.0013793 k( 616) = ( 0.5000000 0.6167651 0.1167651), wk = 0.0013793 k( 617) = ( 0.5000000 0.6128729 0.1128729), wk = 0.0013793 k( 618) = ( 0.5000000 0.6089807 0.1089807), wk = 0.0013793 k( 619) = ( 0.5000000 0.6050886 0.1050886), wk = 0.0013793 k( 620) = ( 0.5000000 0.6011964 0.1011964), wk = 0.0013793 k( 621) = ( 0.5000000 0.5973042 0.0973042), wk = 0.0013793 k( 622) = ( 0.5000000 0.5934121 0.0934121), wk = 0.0013793 k( 623) = ( 0.5000000 0.5895199 0.0895199), wk = 0.0013793 k( 624) = ( 0.5000000 0.5856277 0.0856277), wk = 0.0013793 k( 625) = ( 0.5000000 0.5817356 0.0817356), wk = 0.0013793 k( 626) = ( 0.5000000 0.5778434 0.0778434), wk = 0.0013793 k( 627) = ( 0.5000000 0.5739512 0.0739512), wk = 0.0013793 k( 628) = ( 0.5000000 0.5700591 0.0700590), wk = 0.0013793 k( 629) = ( 0.5000000 0.5661669 0.0661669), wk = 0.0013793 k( 630) = ( 0.5000000 0.5622747 0.0622747), wk = 0.0013793 k( 631) = ( 0.5000000 0.5583825 0.0583825), wk = 0.0013793 k( 632) = ( 0.5000000 0.5544904 0.0544904), wk = 0.0013793 k( 633) = ( 0.5000000 0.5505982 0.0505982), wk = 0.0013793 k( 634) = ( 0.5000000 0.5467060 0.0467060), wk = 0.0013793 k( 635) = ( 0.5000000 0.5428139 0.0428139), wk = 0.0013793 k( 636) = ( 0.5000000 0.5389217 0.0389217), wk = 0.0013793 k( 637) = ( 0.5000000 0.5350295 0.0350295), wk = 0.0013793 k( 638) = ( 0.5000000 0.5311374 0.0311374), wk = 0.0013793 k( 639) = ( 0.5000000 0.5272452 0.0272452), wk = 0.0013793 k( 640) = ( 0.5000000 0.5233530 0.0233530), wk = 0.0013793 k( 641) = ( 0.5000000 0.5194608 0.0194609), wk = 0.0013793 k( 642) = ( 0.5000000 0.5155687 0.0155687), wk = 0.0013793 k( 643) = ( 0.5000000 0.5116765 0.0116765), wk = 0.0013793 k( 644) = ( 0.5000000 0.5077843 0.0077843), wk = 0.0013793 k( 645) = ( 0.5000000 0.5038922 0.0038922), wk = 0.0013793 k( 646) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0013793 k( 647) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0013793 k( 648) = ( 0.4935897 0.4935897 0.4935897), wk = 0.0013793 k( 649) = ( 0.4871795 0.4871795 0.4871795), wk = 0.0013793 k( 650) = ( 0.4807692 0.4807692 0.4807692), wk = 0.0013793 k( 651) = ( 0.4743590 0.4743590 0.4743590), wk = 0.0013793 k( 652) = ( 0.4679487 0.4679487 0.4679487), wk = 0.0013793 k( 653) = ( 0.4615385 0.4615385 0.4615385), wk = 0.0013793 k( 654) = ( 0.4551282 0.4551282 0.4551282), wk = 0.0013793 k( 655) = ( 0.4487179 0.4487179 0.4487179), wk = 0.0013793 k( 656) = ( 0.4423077 0.4423077 0.4423077), wk = 0.0013793 k( 657) = ( 0.4358974 0.4358974 0.4358974), wk = 0.0013793 k( 658) = ( 0.4294872 0.4294872 0.4294872), wk = 0.0013793 k( 659) = ( 0.4230769 0.4230769 0.4230769), wk = 0.0013793 k( 660) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0013793 k( 661) = ( 0.4102564 0.4102564 0.4102564), wk = 0.0013793 k( 662) = ( 0.4038462 0.4038462 0.4038462), wk = 0.0013793 k( 663) = ( 0.3974359 0.3974359 0.3974359), wk = 0.0013793 k( 664) = ( 0.3910256 0.3910256 0.3910256), wk = 0.0013793 k( 665) = ( 0.3846154 0.3846154 0.3846154), wk = 0.0013793 k( 666) = ( 0.3782051 0.3782051 0.3782051), wk = 0.0013793 k( 667) = ( 0.3717949 0.3717949 0.3717949), wk = 0.0013793 k( 668) = ( 0.3653846 0.3653846 0.3653846), wk = 0.0013793 k( 669) = ( 0.3589744 0.3589744 0.3589744), wk = 0.0013793 k( 670) = ( 0.3525641 0.3525641 0.3525641), wk = 0.0013793 k( 671) = ( 0.3461538 0.3461538 0.3461538), wk = 0.0013793 k( 672) = ( 0.3397436 0.3397436 0.3397436), wk = 0.0013793 k( 673) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0013793 k( 674) = ( 0.3269231 0.3269231 0.3269231), wk = 0.0013793 k( 675) = ( 0.3205128 0.3205128 0.3205128), wk = 0.0013793 k( 676) = ( 0.3141026 0.3141026 0.3141026), wk = 0.0013793 k( 677) = ( 0.3076923 0.3076923 0.3076923), wk = 0.0013793 k( 678) = ( 0.3012821 0.3012821 0.3012821), wk = 0.0013793 k( 679) = ( 0.2948718 0.2948718 0.2948718), wk = 0.0013793 k( 680) = ( 0.2884615 0.2884615 0.2884615), wk = 0.0013793 k( 681) = ( 0.2820513 0.2820513 0.2820513), wk = 0.0013793 k( 682) = ( 0.2756410 0.2756410 0.2756410), wk = 0.0013793 k( 683) = ( 0.2692308 0.2692308 0.2692308), wk = 0.0013793 k( 684) = ( 0.2628205 0.2628205 0.2628205), wk = 0.0013793 k( 685) = ( 0.2564103 0.2564103 0.2564103), wk = 0.0013793 k( 686) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0013793 k( 687) = ( 0.2435897 0.2435897 0.2435897), wk = 0.0013793 k( 688) = ( 0.2371795 0.2371795 0.2371795), wk = 0.0013793 k( 689) = ( 0.2307692 0.2307692 0.2307692), wk = 0.0013793 k( 690) = ( 0.2243590 0.2243590 0.2243590), wk = 0.0013793 k( 691) = ( 0.2179487 0.2179487 0.2179487), wk = 0.0013793 k( 692) = ( 0.2115385 0.2115385 0.2115385), wk = 0.0013793 k( 693) = ( 0.2051282 0.2051282 0.2051282), wk = 0.0013793 k( 694) = ( 0.1987180 0.1987180 0.1987180), wk = 0.0013793 k( 695) = ( 0.1923077 0.1923077 0.1923077), wk = 0.0013793 k( 696) = ( 0.1858974 0.1858974 0.1858974), wk = 0.0013793 k( 697) = ( 0.1794872 0.1794872 0.1794872), wk = 0.0013793 k( 698) = ( 0.1730769 0.1730769 0.1730769), wk = 0.0013793 k( 699) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0013793 k( 700) = ( 0.1602564 0.1602564 0.1602564), wk = 0.0013793 k( 701) = ( 0.1538461 0.1538461 0.1538461), wk = 0.0013793 k( 702) = ( 0.1474359 0.1474359 0.1474359), wk = 0.0013793 k( 703) = ( 0.1410256 0.1410256 0.1410256), wk = 0.0013793 k( 704) = ( 0.1346154 0.1346154 0.1346154), wk = 0.0013793 k( 705) = ( 0.1282051 0.1282051 0.1282051), wk = 0.0013793 k( 706) = ( 0.1217949 0.1217949 0.1217949), wk = 0.0013793 k( 707) = ( 0.1153846 0.1153846 0.1153846), wk = 0.0013793 k( 708) = ( 0.1089744 0.1089744 0.1089744), wk = 0.0013793 k( 709) = ( 0.1025641 0.1025641 0.1025641), wk = 0.0013793 k( 710) = ( 0.0961538 0.0961538 0.0961538), wk = 0.0013793 k( 711) = ( 0.0897436 0.0897436 0.0897436), wk = 0.0013793 k( 712) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0013793 k( 713) = ( 0.0769231 0.0769231 0.0769231), wk = 0.0013793 k( 714) = ( 0.0705128 0.0705128 0.0705128), wk = 0.0013793 k( 715) = ( 0.0641026 0.0641026 0.0641026), wk = 0.0013793 k( 716) = ( 0.0576923 0.0576923 0.0576923), wk = 0.0013793 k( 717) = ( 0.0512821 0.0512821 0.0512821), wk = 0.0013793 k( 718) = ( 0.0448718 0.0448718 0.0448718), wk = 0.0013793 k( 719) = ( 0.0384615 0.0384615 0.0384615), wk = 0.0013793 k( 720) = ( 0.0320513 0.0320513 0.0320513), wk = 0.0013793 k( 721) = ( 0.0256410 0.0256410 0.0256410), wk = 0.0013793 k( 722) = ( 0.0192308 0.0192308 0.0192308), wk = 0.0013793 k( 723) = ( 0.0128205 0.0128205 0.0128205), wk = 0.0013793 k( 724) = ( 0.0064103 0.0064103 0.0064103), wk = 0.0013793 k( 725) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0013793 Dense grid: 11779 G-vectors FFT dimensions: ( 45, 40, 27) Smooth grid: 4205 G-vectors FFT dimensions: ( 32, 27, 20) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.01 Mb ( 42, 16) NL pseudopotentials 0.01 Mb ( 21, 28) Each V/rho on FFT grid 0.03 Mb ( 1800) Each G-vector array 0.00 Mb ( 327) G-vector shells 0.00 Mb ( 309) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.04 Mb ( 42, 64) Each subspace H/S matrix 0.00 Mb ( 16, 16) Each matrix 0.01 Mb ( 28, 2, 16) Check: negative/imaginary core charge= -0.000012 0.000000 The potential is recalculated from file : ./C.save/charge-density.dat Starting wfc are 16 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.7 secs Computing kpt #: 2 total cpu time spent up to now is 3.7 secs Computing kpt #: 3 total cpu time spent up to now is 3.7 secs Computing kpt #: 4 total cpu time spent up to now is 3.8 secs Computing kpt #: 5 total cpu time spent up to now is 3.8 secs Computing kpt #: 6 total cpu time spent up to now is 3.8 secs Computing kpt #: 7 total cpu time spent up to now is 3.9 secs Computing kpt #: 8 total cpu time spent up to now is 3.9 secs Computing kpt #: 9 total cpu time spent up to now is 3.9 secs Computing kpt #: 10 total cpu time spent up to now is 4.0 secs Computing kpt #: 11 total cpu time spent up to now is 4.0 secs Computing kpt #: 12 total cpu time spent up to now is 4.0 secs Computing kpt #: 13 total cpu time spent up to now is 4.1 secs Computing kpt #: 14 total cpu time spent up to now is 4.1 secs Computing kpt #: 15 total cpu time spent up to now is 4.1 secs Computing kpt #: 16 total cpu time spent up to now is 4.2 secs Computing kpt #: 17 total cpu time spent up to now is 4.2 secs Computing kpt #: 18 total cpu time spent up to now is 4.2 secs Computing kpt #: 19 total cpu time spent up to now is 4.3 secs Computing kpt #: 20 total cpu time spent up to now is 4.3 secs Computing kpt #: 21 total cpu time spent up to now is 4.3 secs Computing kpt #: 22 total cpu time spent up to now is 4.4 secs Computing kpt #: 23 total cpu time spent up to now is 4.4 secs Computing kpt #: 24 total cpu time spent up to now is 4.4 secs Computing kpt #: 25 total cpu time spent up to now is 4.5 secs Computing kpt #: 26 total cpu time spent up to now is 4.5 secs Computing kpt #: 27 total cpu time spent up to now is 4.5 secs Computing kpt #: 28 total cpu time spent up to now is 4.6 secs Computing kpt #: 29 total cpu time spent up to now is 4.6 secs Computing kpt #: 30 total cpu time spent up to now is 4.6 secs Computing kpt #: 31 total cpu time spent up to now is 4.7 secs Computing kpt #: 32 total cpu time spent up to now is 4.7 secs Computing kpt #: 33 total cpu time spent up to now is 4.7 secs Computing kpt #: 34 total cpu time spent up to now is 4.8 secs Computing kpt #: 35 total cpu time spent up to now is 4.8 secs Computing kpt #: 36 total cpu time spent up to now is 4.8 secs Computing kpt #: 37 total cpu time spent up to now is 4.9 secs Computing kpt #: 38 total cpu time spent up to now is 4.9 secs Computing kpt #: 39 total cpu time spent up to now is 4.9 secs Computing kpt #: 40 total cpu time spent up to now is 5.0 secs Computing kpt #: 41 total cpu time spent up to now is 5.0 secs Computing kpt #: 42 total cpu time spent up to now is 5.1 secs Computing kpt #: 43 total cpu time spent up to now is 5.1 secs Computing kpt #: 44 total cpu time spent up to now is 5.2 secs Computing kpt #: 45 total cpu time spent up to now is 5.2 secs Computing kpt #: 46 total cpu time spent up to now is 5.3 secs Computing kpt #: 47 total cpu time spent up to now is 5.3 secs Computing kpt #: 48 total cpu time spent up to now is 5.4 secs Computing kpt #: 49 total cpu time spent up to now is 5.4 secs Computing kpt #: 50 total cpu time spent up to now is 5.5 secs Computing kpt #: 51 total cpu time spent up to now is 5.5 secs Computing kpt #: 52 total cpu time spent up to now is 5.6 secs Computing kpt #: 53 total cpu time spent up to now is 5.6 secs Computing kpt #: 54 total cpu time spent up to now is 5.6 secs Computing kpt #: 55 total cpu time spent up to now is 5.7 secs Computing kpt #: 56 total cpu time spent up to now is 5.7 secs Computing kpt #: 57 total cpu time spent up to now is 5.8 secs Computing kpt #: 58 total cpu time spent up to now is 5.8 secs Computing kpt #: 59 total cpu time spent up to now is 5.8 secs Computing kpt #: 60 total cpu time spent up to now is 5.9 secs Computing kpt #: 61 total cpu time spent up to now is 5.9 secs Computing kpt #: 62 total cpu time spent up to now is 5.9 secs Computing kpt #: 63 total cpu time spent up to now is 6.0 secs Computing kpt #: 64 total cpu time spent up to now is 6.0 secs Computing kpt #: 65 total cpu time spent up to now is 6.1 secs Computing kpt #: 66 total cpu time spent up to now is 6.1 secs Computing kpt #: 67 total cpu time spent up to now is 6.1 secs Computing kpt #: 68 total cpu time spent up to now is 6.2 secs Computing kpt #: 69 total cpu time spent up to now is 6.2 secs Computing kpt #: 70 total cpu time spent up to now is 6.2 secs Computing kpt #: 71 total cpu time spent up to now is 6.3 secs Computing kpt #: 72 total cpu time spent up to now is 6.3 secs Computing kpt #: 73 total cpu time spent up to now is 6.3 secs Computing kpt #: 74 total cpu time spent up to now is 6.4 secs Computing kpt #: 75 total cpu time spent up to now is 6.4 secs Computing kpt #: 76 total cpu time spent up to now is 6.4 secs Computing kpt #: 77 total cpu time spent up to now is 6.5 secs Computing kpt #: 78 total cpu time spent up to now is 6.5 secs Computing kpt #: 79 total cpu time spent up to now is 6.6 secs Computing kpt #: 80 total cpu time spent up to now is 6.6 secs Computing kpt #: 81 total cpu time spent up to now is 6.6 secs Computing kpt #: 82 total cpu time spent up to now is 6.7 secs Computing kpt #: 83 total cpu time spent up to now is 6.7 secs Computing kpt #: 84 total cpu time spent up to now is 6.7 secs Computing kpt #: 85 total cpu time spent up to now is 6.8 secs Computing kpt #: 86 total cpu time spent up to now is 6.8 secs Computing kpt #: 87 total cpu time spent up to now is 6.8 secs Computing kpt #: 88 total cpu time spent up to now is 6.9 secs Computing kpt #: 89 total cpu time spent up to now is 6.9 secs Computing kpt #: 90 total cpu time spent up to now is 7.0 secs Computing kpt #: 91 total cpu time spent up to now is 7.0 secs Computing kpt #: 92 total cpu time spent up to now is 7.0 secs Computing kpt #: 93 total cpu time spent up to now is 7.1 secs Computing kpt #: 94 total cpu time spent up to now is 7.1 secs Computing kpt #: 95 total cpu time spent up to now is 7.2 secs Computing kpt #: 96 total cpu time spent up to now is 7.2 secs Computing kpt #: 97 total cpu time spent up to now is 7.2 secs Computing kpt #: 98 total cpu time spent up to now is 7.3 secs Computing kpt #: 99 total cpu time spent up to now is 7.3 secs Computing kpt #: 100 total cpu time spent up to now is 7.4 secs Computing kpt #: 101 total cpu time spent up to now is 7.4 secs Computing kpt #: 102 total cpu time spent up to now is 7.4 secs Computing kpt #: 103 total cpu time spent up to now is 7.5 secs Computing kpt #: 104 total cpu time spent up to now is 7.5 secs Computing kpt #: 105 total cpu time spent up to now is 7.6 secs Computing kpt #: 106 total cpu time spent up to now is 7.6 secs Computing kpt #: 107 total cpu time spent up to now is 7.7 secs Computing kpt #: 108 total cpu time spent up to now is 7.7 secs Computing kpt #: 109 total cpu time spent up to now is 7.8 secs Computing kpt #: 110 total cpu time spent up to now is 7.8 secs Computing kpt #: 111 total cpu time spent up to now is 7.9 secs Computing kpt #: 112 total cpu time spent up to now is 7.9 secs Computing kpt #: 113 total cpu time spent up to now is 8.0 secs Computing kpt #: 114 total cpu time spent up to now is 8.0 secs Computing kpt #: 115 total cpu time spent up to now is 8.1 secs Computing kpt #: 116 total cpu time spent up to now is 8.1 secs Computing kpt #: 117 total cpu time spent up to now is 8.2 secs Computing kpt #: 118 total cpu time spent up to now is 8.2 secs Computing kpt #: 119 total cpu time spent up to now is 8.3 secs Computing kpt #: 120 total cpu time spent up to now is 8.3 secs Computing kpt #: 121 total cpu time spent up to now is 8.4 secs Computing kpt #: 122 total cpu time spent up to now is 8.4 secs Computing kpt #: 123 total cpu time spent up to now is 8.5 secs Computing kpt #: 124 total cpu time spent up to now is 8.5 secs Computing kpt #: 125 total cpu time spent up to now is 8.6 secs Computing kpt #: 126 total cpu time spent up to now is 8.6 secs Computing kpt #: 127 total cpu time spent up to now is 8.7 secs Computing kpt #: 128 total cpu time spent up to now is 8.7 secs Computing kpt #: 129 total cpu time spent up to now is 8.8 secs Computing kpt #: 130 total cpu time spent up to now is 8.9 secs Computing kpt #: 131 total cpu time spent up to now is 8.9 secs Computing kpt #: 132 total cpu time spent up to now is 9.0 secs Computing kpt #: 133 total cpu time spent up to now is 9.0 secs Computing kpt #: 134 total cpu time spent up to now is 9.1 secs Computing kpt #: 135 total cpu time spent up to now is 9.1 secs Computing kpt #: 136 total cpu time spent up to now is 9.2 secs Computing kpt #: 137 total cpu time spent up to now is 9.2 secs Computing kpt #: 138 total cpu time spent up to now is 9.3 secs Computing kpt #: 139 total cpu time spent up to now is 9.3 secs Computing kpt #: 140 total cpu time spent up to now is 9.4 secs Computing kpt #: 141 total cpu time spent up to now is 9.4 secs Computing kpt #: 142 total cpu time spent up to now is 9.5 secs Computing kpt #: 143 total cpu time spent up to now is 9.5 secs Computing kpt #: 144 total cpu time spent up to now is 9.6 secs Computing kpt #: 145 total cpu time spent up to now is 9.6 secs Computing kpt #: 146 total cpu time spent up to now is 9.7 secs Computing kpt #: 147 total cpu time spent up to now is 9.7 secs Computing kpt #: 148 total cpu time spent up to now is 9.7 secs Computing kpt #: 149 total cpu time spent up to now is 9.8 secs Computing kpt #: 150 total cpu time spent up to now is 9.8 secs Computing kpt #: 151 total cpu time spent up to now is 9.9 secs Computing kpt #: 152 total cpu time spent up to now is 9.9 secs Computing kpt #: 153 total cpu time spent up to now is 9.9 secs Computing kpt #: 154 total cpu time spent up to now is 10.0 secs Computing kpt #: 155 total cpu time spent up to now is 10.0 secs Computing kpt #: 156 total cpu time spent up to now is 10.1 secs Computing kpt #: 157 total cpu time spent up to now is 10.1 secs Computing kpt #: 158 total cpu time spent up to now is 10.1 secs Computing kpt #: 159 total cpu time spent up to now is 10.2 secs Computing kpt #: 160 total cpu time spent up to now is 10.2 secs Computing kpt #: 161 total cpu time spent up to now is 10.2 secs Computing kpt #: 162 total cpu time spent up to now is 10.3 secs Computing kpt #: 163 total cpu time spent up to now is 10.3 secs Computing kpt #: 164 total cpu time spent up to now is 10.3 secs Computing kpt #: 165 total cpu time spent up to now is 10.4 secs Computing kpt #: 166 total cpu time spent up to now is 10.4 secs Computing kpt #: 167 total cpu time spent up to now is 10.4 secs Computing kpt #: 168 total cpu time spent up to now is 10.5 secs Computing kpt #: 169 total cpu time spent up to now is 10.5 secs Computing kpt #: 170 total cpu time spent up to now is 10.5 secs Computing kpt #: 171 total cpu time spent up to now is 10.6 secs Computing kpt #: 172 total cpu time spent up to now is 10.6 secs Computing kpt #: 173 total cpu time spent up to now is 10.6 secs Computing kpt #: 174 total cpu time spent up to now is 10.6 secs Computing kpt #: 175 total cpu time spent up to now is 10.7 secs Computing kpt #: 176 total cpu time spent up to now is 10.7 secs Computing kpt #: 177 total cpu time spent up to now is 10.7 secs Computing kpt #: 178 total cpu time spent up to now is 10.8 secs Computing kpt #: 179 total cpu time spent up to now is 10.8 secs Computing kpt #: 180 total cpu time spent up to now is 10.8 secs Computing kpt #: 181 total cpu time spent up to now is 10.9 secs Computing kpt #: 182 total cpu time spent up to now is 10.9 secs Computing kpt #: 183 total cpu time spent up to now is 10.9 secs Computing kpt #: 184 total cpu time spent up to now is 11.0 secs Computing kpt #: 185 total cpu time spent up to now is 11.0 secs Computing kpt #: 186 total cpu time spent up to now is 11.0 secs Computing kpt #: 187 total cpu time spent up to now is 11.1 secs Computing kpt #: 188 total cpu time spent up to now is 11.1 secs Computing kpt #: 189 total cpu time spent up to now is 11.1 secs Computing kpt #: 190 total cpu time spent up to now is 11.2 secs Computing kpt #: 191 total cpu time spent up to now is 11.2 secs Computing kpt #: 192 total cpu time spent up to now is 11.2 secs Computing kpt #: 193 total cpu time spent up to now is 11.2 secs Computing kpt #: 194 total cpu time spent up to now is 11.3 secs Computing kpt #: 195 total cpu time spent up to now is 11.3 secs Computing kpt #: 196 total cpu time spent up to now is 11.3 secs Computing kpt #: 197 total cpu time spent up to now is 11.4 secs Computing kpt #: 198 total cpu time spent up to now is 11.4 secs Computing kpt #: 199 total cpu time spent up to now is 11.4 secs Computing kpt #: 200 total cpu time spent up to now is 11.5 secs Computing kpt #: 201 total cpu time spent up to now is 11.5 secs Computing kpt #: 202 total cpu time spent up to now is 11.5 secs Computing kpt #: 203 total cpu time spent up to now is 11.5 secs Computing kpt #: 204 total cpu time spent up to now is 11.6 secs Computing kpt #: 205 total cpu time spent up to now is 11.6 secs Computing kpt #: 206 total cpu time spent up to now is 11.6 secs Computing kpt #: 207 total cpu time spent up to now is 11.7 secs Computing kpt #: 208 total cpu time spent up to now is 11.7 secs Computing kpt #: 209 total cpu time spent up to now is 11.7 secs Computing kpt #: 210 total cpu time spent up to now is 11.8 secs Computing kpt #: 211 total cpu time spent up to now is 11.8 secs Computing kpt #: 212 total cpu time spent up to now is 11.8 secs Computing kpt #: 213 total cpu time spent up to now is 11.9 secs Computing kpt #: 214 total cpu time spent up to now is 11.9 secs Computing kpt #: 215 total cpu time spent up to now is 11.9 secs Computing kpt #: 216 total cpu time spent up to now is 12.0 secs Computing kpt #: 217 total cpu time spent up to now is 12.0 secs Computing kpt #: 218 total cpu time spent up to now is 12.0 secs Computing kpt #: 219 total cpu time spent up to now is 12.1 secs Computing kpt #: 220 total cpu time spent up to now is 12.1 secs Computing kpt #: 221 total cpu time spent up to now is 12.1 secs Computing kpt #: 222 total cpu time spent up to now is 12.2 secs Computing kpt #: 223 total cpu time spent up to now is 12.2 secs Computing kpt #: 224 total cpu time spent up to now is 12.2 secs Computing kpt #: 225 total cpu time spent up to now is 12.2 secs Computing kpt #: 226 total cpu time spent up to now is 12.3 secs Computing kpt #: 227 total cpu time spent up to now is 12.3 secs Computing kpt #: 228 total cpu time spent up to now is 12.3 secs Computing kpt #: 229 total cpu time spent up to now is 12.4 secs Computing kpt #: 230 total cpu time spent up to now is 12.4 secs Computing kpt #: 231 total cpu time spent up to now is 12.4 secs Computing kpt #: 232 total cpu time spent up to now is 12.5 secs Computing kpt #: 233 total cpu time spent up to now is 12.5 secs Computing kpt #: 234 total cpu time spent up to now is 12.5 secs Computing kpt #: 235 total cpu time spent up to now is 12.6 secs Computing kpt #: 236 total cpu time spent up to now is 12.6 secs Computing kpt #: 237 total cpu time spent up to now is 12.6 secs Computing kpt #: 238 total cpu time spent up to now is 12.7 secs Computing kpt #: 239 total cpu time spent up to now is 12.7 secs Computing kpt #: 240 total cpu time spent up to now is 12.7 secs Computing kpt #: 241 total cpu time spent up to now is 12.7 secs Computing kpt #: 242 total cpu time spent up to now is 12.8 secs Computing kpt #: 243 total cpu time spent up to now is 12.8 secs Computing kpt #: 244 total cpu time spent up to now is 12.8 secs Computing kpt #: 245 total cpu time spent up to now is 12.9 secs Computing kpt #: 246 total cpu time spent up to now is 12.9 secs Computing kpt #: 247 total cpu time spent up to now is 12.9 secs Computing kpt #: 248 total cpu time spent up to now is 13.0 secs Computing kpt #: 249 total cpu time spent up to now is 13.0 secs Computing kpt #: 250 total cpu time spent up to now is 13.0 secs Computing kpt #: 251 total cpu time spent up to now is 13.1 secs Computing kpt #: 252 total cpu time spent up to now is 13.1 secs Computing kpt #: 253 total cpu time spent up to now is 13.1 secs Computing kpt #: 254 total cpu time spent up to now is 13.2 secs Computing kpt #: 255 total cpu time spent up to now is 13.2 secs Computing kpt #: 256 total cpu time spent up to now is 13.2 secs Computing kpt #: 257 total cpu time spent up to now is 13.2 secs Computing kpt #: 258 total cpu time spent up to now is 13.3 secs Computing kpt #: 259 total cpu time spent up to now is 13.3 secs Computing kpt #: 260 total cpu time spent up to now is 13.3 secs Computing kpt #: 261 total cpu time spent up to now is 13.4 secs Computing kpt #: 262 total cpu time spent up to now is 13.4 secs Computing kpt #: 263 total cpu time spent up to now is 13.4 secs Computing kpt #: 264 total cpu time spent up to now is 13.5 secs Computing kpt #: 265 total cpu time spent up to now is 13.5 secs Computing kpt #: 266 total cpu time spent up to now is 13.5 secs Computing kpt #: 267 total cpu time spent up to now is 13.6 secs Computing kpt #: 268 total cpu time spent up to now is 13.6 secs Computing kpt #: 269 total cpu time spent up to now is 13.6 secs Computing kpt #: 270 total cpu time spent up to now is 13.7 secs Computing kpt #: 271 total cpu time spent up to now is 13.7 secs Computing kpt #: 272 total cpu time spent up to now is 13.7 secs Computing kpt #: 273 total cpu time spent up to now is 13.8 secs Computing kpt #: 274 total cpu time spent up to now is 13.8 secs Computing kpt #: 275 total cpu time spent up to now is 13.8 secs Computing kpt #: 276 total cpu time spent up to now is 13.9 secs Computing kpt #: 277 total cpu time spent up to now is 13.9 secs Computing kpt #: 278 total cpu time spent up to now is 13.9 secs Computing kpt #: 279 total cpu time spent up to now is 14.0 secs Computing kpt #: 280 total cpu time spent up to now is 14.0 secs Computing kpt #: 281 total cpu time spent up to now is 14.0 secs Computing kpt #: 282 total cpu time spent up to now is 14.1 secs Computing kpt #: 283 total cpu time spent up to now is 14.1 secs Computing kpt #: 284 total cpu time spent up to now is 14.1 secs Computing kpt #: 285 total cpu time spent up to now is 14.1 secs Computing kpt #: 286 total cpu time spent up to now is 14.2 secs Computing kpt #: 287 total cpu time spent up to now is 14.2 secs Computing kpt #: 288 total cpu time spent up to now is 14.2 secs Computing kpt #: 289 total cpu time spent up to now is 14.3 secs Computing kpt #: 290 total cpu time spent up to now is 14.3 secs Computing kpt #: 291 total cpu time spent up to now is 14.3 secs Computing kpt #: 292 total cpu time spent up to now is 14.4 secs Computing kpt #: 293 total cpu time spent up to now is 14.4 secs Computing kpt #: 294 total cpu time spent up to now is 14.4 secs Computing kpt #: 295 total cpu time spent up to now is 14.5 secs Computing kpt #: 296 total cpu time spent up to now is 14.5 secs Computing kpt #: 297 total cpu time spent up to now is 14.5 secs Computing kpt #: 298 total cpu time spent up to now is 14.6 secs Computing kpt #: 299 total cpu time spent up to now is 14.6 secs Computing kpt #: 300 total cpu time spent up to now is 14.6 secs Computing kpt #: 301 total cpu time spent up to now is 14.7 secs Computing kpt #: 302 total cpu time spent up to now is 14.7 secs Computing kpt #: 303 total cpu time spent up to now is 14.8 secs Computing kpt #: 304 total cpu time spent up to now is 14.8 secs Computing kpt #: 305 total cpu time spent up to now is 14.8 secs Computing kpt #: 306 total cpu time spent up to now is 14.9 secs Computing kpt #: 307 total cpu time spent up to now is 14.9 secs Computing kpt #: 308 total cpu time spent up to now is 15.0 secs Computing kpt #: 309 total cpu time spent up to now is 15.0 secs Computing kpt #: 310 total cpu time spent up to now is 15.1 secs Computing kpt #: 311 total cpu time spent up to now is 15.1 secs Computing kpt #: 312 total cpu time spent up to now is 15.2 secs Computing kpt #: 313 total cpu time spent up to now is 15.2 secs Computing kpt #: 314 total cpu time spent up to now is 15.2 secs Computing kpt #: 315 total cpu time spent up to now is 15.3 secs Computing kpt #: 316 total cpu time spent up to now is 15.3 secs Computing kpt #: 317 total cpu time spent up to now is 15.4 secs Computing kpt #: 318 total cpu time spent up to now is 15.4 secs Computing kpt #: 319 total cpu time spent up to now is 15.5 secs Computing kpt #: 320 total cpu time spent up to now is 15.5 secs Computing kpt #: 321 total cpu time spent up to now is 15.6 secs Computing kpt #: 322 total cpu time spent up to now is 15.6 secs Computing kpt #: 323 total cpu time spent up to now is 15.7 secs Computing kpt #: 324 total cpu time spent up to now is 15.7 secs Computing kpt #: 325 total cpu time spent up to now is 15.7 secs Computing kpt #: 326 total cpu time spent up to now is 15.8 secs Computing kpt #: 327 total cpu time spent up to now is 15.8 secs Computing kpt #: 328 total cpu time spent up to now is 15.9 secs Computing kpt #: 329 total cpu time spent up to now is 15.9 secs Computing kpt #: 330 total cpu time spent up to now is 16.0 secs Computing kpt #: 331 total cpu time spent up to now is 16.0 secs Computing kpt #: 332 total cpu time spent up to now is 16.1 secs Computing kpt #: 333 total cpu time spent up to now is 16.1 secs Computing kpt #: 334 total cpu time spent up to now is 16.2 secs Computing kpt #: 335 total cpu time spent up to now is 16.2 secs Computing kpt #: 336 total cpu time spent up to now is 16.3 secs Computing kpt #: 337 total cpu time spent up to now is 16.3 secs Computing kpt #: 338 total cpu time spent up to now is 16.4 secs Computing kpt #: 339 total cpu time spent up to now is 16.4 secs Computing kpt #: 340 total cpu time spent up to now is 16.4 secs Computing kpt #: 341 total cpu time spent up to now is 16.5 secs Computing kpt #: 342 total cpu time spent up to now is 16.5 secs Computing kpt #: 343 total cpu time spent up to now is 16.6 secs Computing kpt #: 344 total cpu time spent up to now is 16.6 secs Computing kpt #: 345 total cpu time spent up to now is 16.6 secs Computing kpt #: 346 total cpu time spent up to now is 16.7 secs Computing kpt #: 347 total cpu time spent up to now is 16.7 secs Computing kpt #: 348 total cpu time spent up to now is 16.8 secs Computing kpt #: 349 total cpu time spent up to now is 16.8 secs Computing kpt #: 350 total cpu time spent up to now is 16.9 secs Computing kpt #: 351 total cpu time spent up to now is 16.9 secs Computing kpt #: 352 total cpu time spent up to now is 16.9 secs Computing kpt #: 353 total cpu time spent up to now is 17.0 secs Computing kpt #: 354 total cpu time spent up to now is 17.0 secs Computing kpt #: 355 total cpu time spent up to now is 17.1 secs Computing kpt #: 356 total cpu time spent up to now is 17.1 secs Computing kpt #: 357 total cpu time spent up to now is 17.2 secs Computing kpt #: 358 total cpu time spent up to now is 17.2 secs Computing kpt #: 359 total cpu time spent up to now is 17.2 secs Computing kpt #: 360 total cpu time spent up to now is 17.3 secs Computing kpt #: 361 total cpu time spent up to now is 17.3 secs Computing kpt #: 362 total cpu time spent up to now is 17.4 secs Computing kpt #: 363 total cpu time spent up to now is 17.4 secs Computing kpt #: 364 total cpu time spent up to now is 17.5 secs Computing kpt #: 365 total cpu time spent up to now is 17.5 secs Computing kpt #: 366 total cpu time spent up to now is 17.5 secs Computing kpt #: 367 total cpu time spent up to now is 17.6 secs Computing kpt #: 368 total cpu time spent up to now is 17.6 secs Computing kpt #: 369 total cpu time spent up to now is 17.7 secs Computing kpt #: 370 total cpu time spent up to now is 17.7 secs Computing kpt #: 371 total cpu time spent up to now is 17.8 secs Computing kpt #: 372 total cpu time spent up to now is 17.8 secs Computing kpt #: 373 total cpu time spent up to now is 17.9 secs Computing kpt #: 374 total cpu time spent up to now is 17.9 secs Computing kpt #: 375 total cpu time spent up to now is 18.0 secs Computing kpt #: 376 total cpu time spent up to now is 18.0 secs Computing kpt #: 377 total cpu time spent up to now is 18.0 secs Computing kpt #: 378 total cpu time spent up to now is 18.1 secs Computing kpt #: 379 total cpu time spent up to now is 18.1 secs Computing kpt #: 380 total cpu time spent up to now is 18.2 secs Computing kpt #: 381 total cpu time spent up to now is 18.2 secs Computing kpt #: 382 total cpu time spent up to now is 18.3 secs Computing kpt #: 383 total cpu time spent up to now is 18.3 secs Computing kpt #: 384 total cpu time spent up to now is 18.3 secs Computing kpt #: 385 total cpu time spent up to now is 18.4 secs Computing kpt #: 386 total cpu time spent up to now is 18.4 secs Computing kpt #: 387 total cpu time spent up to now is 18.5 secs Computing kpt #: 388 total cpu time spent up to now is 18.5 secs Computing kpt #: 389 total cpu time spent up to now is 18.6 secs Computing kpt #: 390 total cpu time spent up to now is 18.6 secs Computing kpt #: 391 total cpu time spent up to now is 18.6 secs Computing kpt #: 392 total cpu time spent up to now is 18.7 secs Computing kpt #: 393 total cpu time spent up to now is 18.7 secs Computing kpt #: 394 total cpu time spent up to now is 18.8 secs Computing kpt #: 395 total cpu time spent up to now is 18.8 secs Computing kpt #: 396 total cpu time spent up to now is 18.9 secs Computing kpt #: 397 total cpu time spent up to now is 18.9 secs Computing kpt #: 398 total cpu time spent up to now is 19.0 secs Computing kpt #: 399 total cpu time spent up to now is 19.0 secs Computing kpt #: 400 total cpu time spent up to now is 19.1 secs Computing kpt #: 401 total cpu time spent up to now is 19.1 secs Computing kpt #: 402 total cpu time spent up to now is 19.1 secs Computing kpt #: 403 total cpu time spent up to now is 19.2 secs Computing kpt #: 404 total cpu time spent up to now is 19.2 secs Computing kpt #: 405 total cpu time spent up to now is 19.3 secs Computing kpt #: 406 total cpu time spent up to now is 19.3 secs Computing kpt #: 407 total cpu time spent up to now is 19.4 secs Computing kpt #: 408 total cpu time spent up to now is 19.4 secs Computing kpt #: 409 total cpu time spent up to now is 19.5 secs Computing kpt #: 410 total cpu time spent up to now is 19.5 secs Computing kpt #: 411 total cpu time spent up to now is 19.6 secs Computing kpt #: 412 total cpu time spent up to now is 19.6 secs Computing kpt #: 413 total cpu time spent up to now is 19.6 secs Computing kpt #: 414 total cpu time spent up to now is 19.7 secs Computing kpt #: 415 total cpu time spent up to now is 19.7 secs Computing kpt #: 416 total cpu time spent up to now is 19.8 secs Computing kpt #: 417 total cpu time spent up to now is 19.8 secs Computing kpt #: 418 total cpu time spent up to now is 19.9 secs Computing kpt #: 419 total cpu time spent up to now is 19.9 secs Computing kpt #: 420 total cpu time spent up to now is 20.0 secs Computing kpt #: 421 total cpu time spent up to now is 20.0 secs Computing kpt #: 422 total cpu time spent up to now is 20.0 secs Computing kpt #: 423 total cpu time spent up to now is 20.1 secs Computing kpt #: 424 total cpu time spent up to now is 20.1 secs Computing kpt #: 425 total cpu time spent up to now is 20.2 secs Computing kpt #: 426 total cpu time spent up to now is 20.2 secs Computing kpt #: 427 total cpu time spent up to now is 20.3 secs Computing kpt #: 428 total cpu time spent up to now is 20.3 secs Computing kpt #: 429 total cpu time spent up to now is 20.4 secs Computing kpt #: 430 total cpu time spent up to now is 20.4 secs Computing kpt #: 431 total cpu time spent up to now is 20.4 secs Computing kpt #: 432 total cpu time spent up to now is 20.5 secs Computing kpt #: 433 total cpu time spent up to now is 20.5 secs Computing kpt #: 434 total cpu time spent up to now is 20.6 secs Computing kpt #: 435 total cpu time spent up to now is 20.6 secs Computing kpt #: 436 total cpu time spent up to now is 20.7 secs Computing kpt #: 437 total cpu time spent up to now is 20.7 secs Computing kpt #: 438 total cpu time spent up to now is 20.8 secs Computing kpt #: 439 total cpu time spent up to now is 20.8 secs Computing kpt #: 440 total cpu time spent up to now is 20.9 secs Computing kpt #: 441 total cpu time spent up to now is 20.9 secs Computing kpt #: 442 total cpu time spent up to now is 20.9 secs Computing kpt #: 443 total cpu time spent up to now is 21.0 secs Computing kpt #: 444 total cpu time spent up to now is 21.0 secs Computing kpt #: 445 total cpu time spent up to now is 21.1 secs Computing kpt #: 446 total cpu time spent up to now is 21.1 secs Computing kpt #: 447 total cpu time spent up to now is 21.2 secs Computing kpt #: 448 total cpu time spent up to now is 21.2 secs Computing kpt #: 449 total cpu time spent up to now is 21.3 secs Computing kpt #: 450 total cpu time spent up to now is 21.3 secs Computing kpt #: 451 total cpu time spent up to now is 21.4 secs Computing kpt #: 452 total cpu time spent up to now is 21.4 secs Computing kpt #: 453 total cpu time spent up to now is 21.4 secs Computing kpt #: 454 total cpu time spent up to now is 21.5 secs Computing kpt #: 455 total cpu time spent up to now is 21.5 secs Computing kpt #: 456 total cpu time spent up to now is 21.6 secs Computing kpt #: 457 total cpu time spent up to now is 21.6 secs Computing kpt #: 458 total cpu time spent up to now is 21.6 secs Computing kpt #: 459 total cpu time spent up to now is 21.7 secs Computing kpt #: 460 total cpu time spent up to now is 21.7 secs Computing kpt #: 461 total cpu time spent up to now is 21.7 secs Computing kpt #: 462 total cpu time spent up to now is 21.8 secs Computing kpt #: 463 total cpu time spent up to now is 21.8 secs Computing kpt #: 464 total cpu time spent up to now is 21.9 secs Computing kpt #: 465 total cpu time spent up to now is 21.9 secs Computing kpt #: 466 total cpu time spent up to now is 21.9 secs Computing kpt #: 467 total cpu time spent up to now is 22.0 secs Computing kpt #: 468 total cpu time spent up to now is 22.0 secs Computing kpt #: 469 total cpu time spent up to now is 22.0 secs Computing kpt #: 470 total cpu time spent up to now is 22.1 secs Computing kpt #: 471 total cpu time spent up to now is 22.1 secs Computing kpt #: 472 total cpu time spent up to now is 22.1 secs Computing kpt #: 473 total cpu time spent up to now is 22.2 secs Computing kpt #: 474 total cpu time spent up to now is 22.2 secs Computing kpt #: 475 total cpu time spent up to now is 22.3 secs Computing kpt #: 476 total cpu time spent up to now is 22.3 secs Computing kpt #: 477 total cpu time spent up to now is 22.3 secs Computing kpt #: 478 total cpu time spent up to now is 22.4 secs Computing kpt #: 479 total cpu time spent up to now is 22.4 secs Computing kpt #: 480 total cpu time spent up to now is 22.4 secs Computing kpt #: 481 total cpu time spent up to now is 22.5 secs Computing kpt #: 482 total cpu time spent up to now is 22.5 secs Computing kpt #: 483 total cpu time spent up to now is 22.6 secs Computing kpt #: 484 total cpu time spent up to now is 22.6 secs Computing kpt #: 485 total cpu time spent up to now is 22.7 secs Computing kpt #: 486 total cpu time spent up to now is 22.7 secs Computing kpt #: 487 total cpu time spent up to now is 22.8 secs Computing kpt #: 488 total cpu time spent up to now is 22.8 secs Computing kpt #: 489 total cpu time spent up to now is 22.9 secs Computing kpt #: 490 total cpu time spent up to now is 22.9 secs Computing kpt #: 491 total cpu time spent up to now is 23.0 secs Computing kpt #: 492 total cpu time spent up to now is 23.0 secs Computing kpt #: 493 total cpu time spent up to now is 23.1 secs Computing kpt #: 494 total cpu time spent up to now is 23.1 secs Computing kpt #: 495 total cpu time spent up to now is 23.2 secs Computing kpt #: 496 total cpu time spent up to now is 23.2 secs Computing kpt #: 497 total cpu time spent up to now is 23.3 secs Computing kpt #: 498 total cpu time spent up to now is 23.4 secs Computing kpt #: 499 total cpu time spent up to now is 23.4 secs Computing kpt #: 500 total cpu time spent up to now is 23.4 secs Computing kpt #: 501 total cpu time spent up to now is 23.5 secs Computing kpt #: 502 total cpu time spent up to now is 23.5 secs Computing kpt #: 503 total cpu time spent up to now is 23.6 secs Computing kpt #: 504 total cpu time spent up to now is 23.6 secs Computing kpt #: 505 total cpu time spent up to now is 23.6 secs Computing kpt #: 506 total cpu time spent up to now is 23.7 secs Computing kpt #: 507 total cpu time spent up to now is 23.7 secs Computing kpt #: 508 total cpu time spent up to now is 23.8 secs Computing kpt #: 509 total cpu time spent up to now is 23.8 secs Computing kpt #: 510 total cpu time spent up to now is 23.8 secs Computing kpt #: 511 total cpu time spent up to now is 23.9 secs Computing kpt #: 512 total cpu time spent up to now is 23.9 secs Computing kpt #: 513 total cpu time spent up to now is 23.9 secs Computing kpt #: 514 total cpu time spent up to now is 24.0 secs Computing kpt #: 515 total cpu time spent up to now is 24.0 secs Computing kpt #: 516 total cpu time spent up to now is 24.1 secs Computing kpt #: 517 total cpu time spent up to now is 24.1 secs Computing kpt #: 518 total cpu time spent up to now is 24.1 secs Computing kpt #: 519 total cpu time spent up to now is 24.2 secs Computing kpt #: 520 total cpu time spent up to now is 24.2 secs Computing kpt #: 521 total cpu time spent up to now is 24.3 secs Computing kpt #: 522 total cpu time spent up to now is 24.3 secs Computing kpt #: 523 total cpu time spent up to now is 24.4 secs Computing kpt #: 524 total cpu time spent up to now is 24.4 secs Computing kpt #: 525 total cpu time spent up to now is 24.4 secs Computing kpt #: 526 total cpu time spent up to now is 24.5 secs Computing kpt #: 527 total cpu time spent up to now is 24.5 secs Computing kpt #: 528 total cpu time spent up to now is 24.6 secs Computing kpt #: 529 total cpu time spent up to now is 24.6 secs Computing kpt #: 530 total cpu time spent up to now is 24.6 secs Computing kpt #: 531 total cpu time spent up to now is 24.7 secs Computing kpt #: 532 total cpu time spent up to now is 24.7 secs Computing kpt #: 533 total cpu time spent up to now is 24.8 secs Computing kpt #: 534 total cpu time spent up to now is 24.8 secs Computing kpt #: 535 total cpu time spent up to now is 24.9 secs Computing kpt #: 536 total cpu time spent up to now is 24.9 secs Computing kpt #: 537 total cpu time spent up to now is 24.9 secs Computing kpt #: 538 total cpu time spent up to now is 25.0 secs Computing kpt #: 539 total cpu time spent up to now is 25.0 secs Computing kpt #: 540 total cpu time spent up to now is 25.1 secs Computing kpt #: 541 total cpu time spent up to now is 25.1 secs Computing kpt #: 542 total cpu time spent up to now is 25.2 secs Computing kpt #: 543 total cpu time spent up to now is 25.2 secs Computing kpt #: 544 total cpu time spent up to now is 25.3 secs Computing kpt #: 545 total cpu time spent up to now is 25.3 secs Computing kpt #: 546 total cpu time spent up to now is 25.4 secs Computing kpt #: 547 total cpu time spent up to now is 25.5 secs Computing kpt #: 548 total cpu time spent up to now is 25.5 secs Computing kpt #: 549 total cpu time spent up to now is 25.6 secs Computing kpt #: 550 total cpu time spent up to now is 25.6 secs Computing kpt #: 551 total cpu time spent up to now is 25.7 secs Computing kpt #: 552 total cpu time spent up to now is 25.7 secs Computing kpt #: 553 total cpu time spent up to now is 25.8 secs Computing kpt #: 554 total cpu time spent up to now is 25.8 secs Computing kpt #: 555 total cpu time spent up to now is 25.9 secs Computing kpt #: 556 total cpu time spent up to now is 25.9 secs Computing kpt #: 557 total cpu time spent up to now is 26.0 secs Computing kpt #: 558 total cpu time spent up to now is 26.0 secs Computing kpt #: 559 total cpu time spent up to now is 26.1 secs Computing kpt #: 560 total cpu time spent up to now is 26.1 secs Computing kpt #: 561 total cpu time spent up to now is 26.1 secs Computing kpt #: 562 total cpu time spent up to now is 26.2 secs Computing kpt #: 563 total cpu time spent up to now is 26.2 secs Computing kpt #: 564 total cpu time spent up to now is 26.3 secs Computing kpt #: 565 total cpu time spent up to now is 26.3 secs Computing kpt #: 566 total cpu time spent up to now is 26.4 secs Computing kpt #: 567 total cpu time spent up to now is 26.4 secs Computing kpt #: 568 total cpu time spent up to now is 26.5 secs Computing kpt #: 569 total cpu time spent up to now is 26.5 secs Computing kpt #: 570 total cpu time spent up to now is 26.5 secs Computing kpt #: 571 total cpu time spent up to now is 26.6 secs Computing kpt #: 572 total cpu time spent up to now is 26.6 secs Computing kpt #: 573 total cpu time spent up to now is 26.7 secs Computing kpt #: 574 total cpu time spent up to now is 26.7 secs Computing kpt #: 575 total cpu time spent up to now is 26.8 secs Computing kpt #: 576 total cpu time spent up to now is 26.8 secs Computing kpt #: 577 total cpu time spent up to now is 26.9 secs Computing kpt #: 578 total cpu time spent up to now is 26.9 secs Computing kpt #: 579 total cpu time spent up to now is 27.0 secs Computing kpt #: 580 total cpu time spent up to now is 27.0 secs Computing kpt #: 581 total cpu time spent up to now is 27.1 secs Computing kpt #: 582 total cpu time spent up to now is 27.1 secs Computing kpt #: 583 total cpu time spent up to now is 27.2 secs Computing kpt #: 584 total cpu time spent up to now is 27.2 secs Computing kpt #: 585 total cpu time spent up to now is 27.3 secs Computing kpt #: 586 total cpu time spent up to now is 27.3 secs Computing kpt #: 587 total cpu time spent up to now is 27.4 secs Computing kpt #: 588 total cpu time spent up to now is 27.4 secs Computing kpt #: 589 total cpu time spent up to now is 27.4 secs Computing kpt #: 590 total cpu time spent up to now is 27.5 secs Computing kpt #: 591 total cpu time spent up to now is 27.5 secs Computing kpt #: 592 total cpu time spent up to now is 27.6 secs Computing kpt #: 593 total cpu time spent up to now is 27.6 secs Computing kpt #: 594 total cpu time spent up to now is 27.7 secs Computing kpt #: 595 total cpu time spent up to now is 27.7 secs Computing kpt #: 596 total cpu time spent up to now is 27.8 secs Computing kpt #: 597 total cpu time spent up to now is 27.8 secs Computing kpt #: 598 total cpu time spent up to now is 27.9 secs Computing kpt #: 599 total cpu time spent up to now is 27.9 secs Computing kpt #: 600 total cpu time spent up to now is 28.0 secs Computing kpt #: 601 total cpu time spent up to now is 28.0 secs Computing kpt #: 602 total cpu time spent up to now is 28.1 secs Computing kpt #: 603 total cpu time spent up to now is 28.1 secs Computing kpt #: 604 total cpu time spent up to now is 28.4 secs Computing kpt #: 605 total cpu time spent up to now is 28.5 secs Computing kpt #: 606 total cpu time spent up to now is 28.5 secs Computing kpt #: 607 total cpu time spent up to now is 28.7 secs Computing kpt #: 608 total cpu time spent up to now is 28.7 secs Computing kpt #: 609 total cpu time spent up to now is 28.8 secs Computing kpt #: 610 total cpu time spent up to now is 28.8 secs Computing kpt #: 611 total cpu time spent up to now is 28.8 secs Computing kpt #: 612 total cpu time spent up to now is 28.9 secs Computing kpt #: 613 total cpu time spent up to now is 28.9 secs Computing kpt #: 614 total cpu time spent up to now is 28.9 secs Computing kpt #: 615 total cpu time spent up to now is 29.0 secs Computing kpt #: 616 total cpu time spent up to now is 29.0 secs Computing kpt #: 617 total cpu time spent up to now is 29.1 secs Computing kpt #: 618 total cpu time spent up to now is 29.1 secs Computing kpt #: 619 total cpu time spent up to now is 29.1 secs Computing kpt #: 620 total cpu time spent up to now is 29.2 secs Computing kpt #: 621 total cpu time spent up to now is 29.2 secs Computing kpt #: 622 total cpu time spent up to now is 29.2 secs Computing kpt #: 623 total cpu time spent up to now is 29.3 secs Computing kpt #: 624 total cpu time spent up to now is 29.3 secs Computing kpt #: 625 total cpu time spent up to now is 29.3 secs Computing kpt #: 626 total cpu time spent up to now is 29.4 secs Computing kpt #: 627 total cpu time spent up to now is 29.4 secs Computing kpt #: 628 total cpu time spent up to now is 29.4 secs Computing kpt #: 629 total cpu time spent up to now is 29.5 secs Computing kpt #: 630 total cpu time spent up to now is 29.5 secs Computing kpt #: 631 total cpu time spent up to now is 29.5 secs Computing kpt #: 632 total cpu time spent up to now is 29.6 secs Computing kpt #: 633 total cpu time spent up to now is 29.6 secs Computing kpt #: 634 total cpu time spent up to now is 29.6 secs Computing kpt #: 635 total cpu time spent up to now is 29.7 secs Computing kpt #: 636 total cpu time spent up to now is 29.7 secs Computing kpt #: 637 total cpu time spent up to now is 29.7 secs Computing kpt #: 638 total cpu time spent up to now is 29.8 secs Computing kpt #: 639 total cpu time spent up to now is 29.8 secs Computing kpt #: 640 total cpu time spent up to now is 29.8 secs Computing kpt #: 641 total cpu time spent up to now is 29.9 secs Computing kpt #: 642 total cpu time spent up to now is 29.9 secs Computing kpt #: 643 total cpu time spent up to now is 29.9 secs Computing kpt #: 644 total cpu time spent up to now is 30.0 secs Computing kpt #: 645 total cpu time spent up to now is 30.0 secs Computing kpt #: 646 total cpu time spent up to now is 30.0 secs Computing kpt #: 647 total cpu time spent up to now is 30.1 secs Computing kpt #: 648 total cpu time spent up to now is 30.1 secs Computing kpt #: 649 total cpu time spent up to now is 30.1 secs Computing kpt #: 650 total cpu time spent up to now is 30.2 secs Computing kpt #: 651 total cpu time spent up to now is 30.2 secs Computing kpt #: 652 total cpu time spent up to now is 30.3 secs Computing kpt #: 653 total cpu time spent up to now is 30.3 secs Computing kpt #: 654 total cpu time spent up to now is 30.3 secs Computing kpt #: 655 total cpu time spent up to now is 30.4 secs Computing kpt #: 656 total cpu time spent up to now is 30.4 secs Computing kpt #: 657 total cpu time spent up to now is 30.5 secs Computing kpt #: 658 total cpu time spent up to now is 30.5 secs Computing kpt #: 659 total cpu time spent up to now is 30.6 secs Computing kpt #: 660 total cpu time spent up to now is 30.6 secs Computing kpt #: 661 total cpu time spent up to now is 30.7 secs Computing kpt #: 662 total cpu time spent up to now is 30.7 secs Computing kpt #: 663 total cpu time spent up to now is 30.7 secs Computing kpt #: 664 total cpu time spent up to now is 30.8 secs Computing kpt #: 665 total cpu time spent up to now is 30.8 secs Computing kpt #: 666 total cpu time spent up to now is 30.9 secs Computing kpt #: 667 total cpu time spent up to now is 30.9 secs Computing kpt #: 668 total cpu time spent up to now is 31.0 secs Computing kpt #: 669 total cpu time spent up to now is 31.0 secs Computing kpt #: 670 total cpu time spent up to now is 31.1 secs Computing kpt #: 671 total cpu time spent up to now is 31.2 secs Computing kpt #: 672 total cpu time spent up to now is 31.2 secs Computing kpt #: 673 total cpu time spent up to now is 31.3 secs Computing kpt #: 674 total cpu time spent up to now is 31.3 secs Computing kpt #: 675 total cpu time spent up to now is 31.4 secs Computing kpt #: 676 total cpu time spent up to now is 31.4 secs Computing kpt #: 677 total cpu time spent up to now is 31.5 secs Computing kpt #: 678 total cpu time spent up to now is 31.5 secs Computing kpt #: 679 total cpu time spent up to now is 31.6 secs Computing kpt #: 680 total cpu time spent up to now is 31.6 secs Computing kpt #: 681 total cpu time spent up to now is 31.7 secs Computing kpt #: 682 total cpu time spent up to now is 31.7 secs Computing kpt #: 683 total cpu time spent up to now is 31.7 secs Computing kpt #: 684 total cpu time spent up to now is 31.8 secs Computing kpt #: 685 total cpu time spent up to now is 31.8 secs Computing kpt #: 686 total cpu time spent up to now is 31.8 secs Computing kpt #: 687 total cpu time spent up to now is 31.9 secs Computing kpt #: 688 total cpu time spent up to now is 31.9 secs Computing kpt #: 689 total cpu time spent up to now is 31.9 secs Computing kpt #: 690 total cpu time spent up to now is 32.0 secs Computing kpt #: 691 total cpu time spent up to now is 32.0 secs Computing kpt #: 692 total cpu time spent up to now is 32.0 secs Computing kpt #: 693 total cpu time spent up to now is 32.1 secs Computing kpt #: 694 total cpu time spent up to now is 32.1 secs Computing kpt #: 695 total cpu time spent up to now is 32.2 secs Computing kpt #: 696 total cpu time spent up to now is 32.2 secs Computing kpt #: 697 total cpu time spent up to now is 32.2 secs Computing kpt #: 698 total cpu time spent up to now is 32.3 secs Computing kpt #: 699 total cpu time spent up to now is 32.3 secs Computing kpt #: 700 total cpu time spent up to now is 32.3 secs Computing kpt #: 701 total cpu time spent up to now is 32.4 secs Computing kpt #: 702 total cpu time spent up to now is 32.4 secs Computing kpt #: 703 total cpu time spent up to now is 32.5 secs Computing kpt #: 704 total cpu time spent up to now is 32.5 secs Computing kpt #: 705 total cpu time spent up to now is 32.5 secs Computing kpt #: 706 total cpu time spent up to now is 32.6 secs Computing kpt #: 707 total cpu time spent up to now is 32.6 secs Computing kpt #: 708 total cpu time spent up to now is 32.6 secs Computing kpt #: 709 total cpu time spent up to now is 32.7 secs Computing kpt #: 710 total cpu time spent up to now is 32.7 secs Computing kpt #: 711 total cpu time spent up to now is 32.7 secs Computing kpt #: 712 total cpu time spent up to now is 32.8 secs Computing kpt #: 713 total cpu time spent up to now is 32.8 secs Computing kpt #: 714 total cpu time spent up to now is 32.8 secs Computing kpt #: 715 total cpu time spent up to now is 32.9 secs Computing kpt #: 716 total cpu time spent up to now is 32.9 secs Computing kpt #: 717 total cpu time spent up to now is 32.9 secs Computing kpt #: 718 total cpu time spent up to now is 33.0 secs Computing kpt #: 719 total cpu time spent up to now is 33.0 secs Computing kpt #: 720 total cpu time spent up to now is 33.1 secs Computing kpt #: 721 total cpu time spent up to now is 33.1 secs Computing kpt #: 722 total cpu time spent up to now is 33.1 secs Computing kpt #: 723 total cpu time spent up to now is 33.2 secs Computing kpt #: 724 total cpu time spent up to now is 33.2 secs Computing kpt #: 725 total cpu time spent up to now is 33.2 secs ethr = 1.25E-07, avg # of iterations = 9.6 total cpu time spent up to now is 33.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 525 PWs) bands (ev): -12.6284 -12.6284 0.4915 0.4915 4.0754 4.0754 4.1020 4.1020 11.3796 11.3796 15.5335 15.5335 15.6065 15.6065 18.6227 18.6227 k = 0.0068-0.0088 0.0060 ( 525 PWs) bands (ev): -12.6273 -12.6273 0.4928 0.4928 4.0709 4.0709 4.0996 4.0996 11.3809 11.3809 15.5345 15.5345 15.6113 15.6113 18.6191 18.6191 k = 0.0135-0.0176 0.0120 ( 525 PWs) bands (ev): -12.6240 -12.6240 0.4965 0.4965 4.0573 4.0573 4.0922 4.0922 11.3849 11.3849 15.5373 15.5373 15.6256 15.6256 18.6082 18.6082 k = 0.0203-0.0263 0.0180 ( 525 PWs) bands (ev): -12.6185 -12.6185 0.5028 0.5028 4.0347 4.0347 4.0801 4.0801 11.3915 11.3915 15.5419 15.5419 15.6494 15.6494 18.5902 18.5902 k = 0.0270-0.0351 0.0240 ( 525 PWs) bands (ev): -12.6109 -12.6109 0.5116 0.5116 4.0031 4.0031 4.0633 4.0633 11.4007 11.4007 15.5483 15.5483 15.6827 15.6827 18.5650 18.5650 k = 0.0338-0.0439 0.0300 ( 525 PWs) bands (ev): -12.6010 -12.6010 0.5229 0.5229 3.9626 3.9626 4.0420 4.0420 11.4126 11.4126 15.5561 15.5561 15.7253 15.7253 18.5327 18.5327 k = 0.0405-0.0527 0.0360 ( 525 PWs) bands (ev): -12.5890 -12.5890 0.5367 0.5367 3.9135 3.9135 4.0162 4.0162 11.4271 11.4271 15.5653 15.5653 15.7771 15.7771 18.4935 18.4935 k = 0.0473-0.0614 0.0420 ( 523 PWs) bands (ev): -12.5747 -12.5747 0.5530 0.5530 3.8561 3.8561 3.9861 3.9861 11.4443 11.4443 15.5759 15.5759 15.8380 15.8380 18.4474 18.4474 k = 0.0541-0.0702 0.0480 ( 523 PWs) bands (ev): -12.5583 -12.5583 0.5718 0.5718 3.7902 3.7902 3.9518 3.9518 11.4641 11.4641 15.5870 15.5870 15.9077 15.9077 18.3945 18.3945 k = 0.0608-0.0790 0.0540 ( 523 PWs) bands (ev): -12.5397 -12.5397 0.5931 0.5931 3.7163 3.7163 3.9136 3.9136 11.4865 11.4865 15.5987 15.5987 15.9861 15.9861 18.3350 18.3350 k = 0.0676-0.0878 0.0600 ( 523 PWs) bands (ev): -12.5189 -12.5189 0.6169 0.6169 3.6348 3.6348 3.8715 3.8715 11.5117 11.5117 15.6107 15.6107 16.0731 16.0731 18.2691 18.2691 k = 0.0743-0.0966 0.0660 ( 519 PWs) bands (ev): -12.4960 -12.4960 0.6432 0.6432 3.5458 3.5458 3.8262 3.8262 11.5394 11.5394 15.6227 15.6227 16.1682 16.1682 18.1970 18.1970 k = 0.0811-0.1053 0.0721 ( 523 PWs) bands (ev): -12.4708 -12.4708 0.6719 0.6719 3.4497 3.4497 3.7771 3.7771 11.5699 11.5699 15.6343 15.6343 16.2714 16.2714 18.1182 18.1182 k = 0.0878-0.1141 0.0781 ( 523 PWs) bands (ev): -12.4435 -12.4435 0.7032 0.7032 3.3468 3.3468 3.7250 3.7250 11.6030 11.6030 15.6455 15.6455 16.3823 16.3823 18.0339 18.0339 k = 0.0946-0.1229 0.0841 ( 519 PWs) bands (ev): -12.4140 -12.4140 0.7369 0.7369 3.2377 3.2377 3.6703 3.6703 11.6387 11.6387 15.6560 15.6560 16.5016 16.5016 17.9438 17.9438 k = 0.1014-0.1317 0.0901 ( 518 PWs) bands (ev): -12.3823 -12.3823 0.7730 0.7730 3.1224 3.1224 3.6125 3.6125 11.6771 11.6771 15.6656 15.6656 16.6274 16.6274 17.8482 17.8482 k = 0.1081-0.1405 0.0961 ( 520 PWs) bands (ev): -12.3485 -12.3485 0.8117 0.8117 3.0008 3.0008 3.5524 3.5524 11.7182 11.7182 15.6735 15.6735 16.7602 16.7602 17.7472 17.7472 k = 0.1149-0.1492 0.1021 ( 520 PWs) bands (ev): -12.3124 -12.3124 0.8527 0.8527 2.8741 2.8741 3.4899 3.4899 11.7620 11.7620 15.6803 15.6803 16.8997 16.8997 17.6411 17.6411 k = 0.1216-0.1580 0.1081 ( 520 PWs) bands (ev): -12.2743 -12.2743 0.8963 0.8963 2.7423 2.7423 3.4255 3.4255 11.8084 11.8084 15.6854 15.6854 17.0457 17.0457 17.5300 17.5300 k = 0.1284-0.1668 0.1141 ( 520 PWs) bands (ev): -12.2339 -12.2339 0.9422 0.9422 2.6057 2.6057 3.3593 3.3593 11.8575 11.8575 15.6889 15.6889 17.1980 17.1980 17.4142 17.4142 k = 0.1351-0.1756 0.1201 ( 520 PWs) bands (ev): -12.1914 -12.1914 0.9905 0.9905 2.4645 2.4645 3.2916 3.2916 11.9092 11.9092 15.6907 15.6907 17.2938 17.2938 17.3563 17.3563 k = 0.1419-0.1843 0.1261 ( 524 PWs) bands (ev): -12.1468 -12.1468 1.0412 1.0412 2.3191 2.3191 3.2224 3.2224 11.9636 11.9636 15.6905 15.6905 17.1691 17.1691 17.5200 17.5200 k = 0.1486-0.1931 0.1321 ( 524 PWs) bands (ev): -12.0999 -12.0999 1.0943 1.0943 2.1698 2.1698 3.1521 3.1521 12.0206 12.0206 15.6887 15.6887 17.0403 17.0403 17.6895 17.6895 k = 0.1554-0.2019 0.1381 ( 524 PWs) bands (ev): -12.0510 -12.0510 1.1499 1.1499 2.0168 2.0168 3.0809 3.0809 12.0803 12.0803 15.6849 15.6849 16.9075 16.9075 17.8642 17.8642 k = 0.1622-0.2107 0.1441 ( 524 PWs) bands (ev): -11.9998 -11.9998 1.2078 1.2078 1.8605 1.8605 3.0089 3.0089 12.1426 12.1426 15.6794 15.6794 16.7709 16.7709 18.0440 18.0440 k = 0.1689-0.2195 0.1501 ( 524 PWs) bands (ev): -11.9466 -11.9466 1.2680 1.2680 1.7011 1.7011 2.9363 2.9363 12.2076 12.2076 15.6721 15.6721 16.6308 16.6308 18.2285 18.2285 k = 0.1757-0.2282 0.1561 ( 524 PWs) bands (ev): -11.8911 -11.8911 1.3306 1.3306 1.5388 1.5388 2.8632 2.8632 12.2752 12.2752 15.6631 15.6631 16.4871 16.4871 18.4177 18.4177 k = 0.1824-0.2370 0.1621 ( 524 PWs) bands (ev): -11.8336 -11.8336 1.3738 1.3738 1.3955 1.3955 2.7899 2.7899 12.3454 12.3454 15.6525 15.6525 16.3404 16.3404 18.6111 18.6111 k = 0.1892-0.2458 0.1681 ( 518 PWs) bands (ev): -11.7738 -11.7738 1.2066 1.2066 1.4628 1.4628 2.7166 2.7166 12.4182 12.4182 15.6407 15.6407 16.1907 16.1907 18.8094 18.8094 k = 0.1959-0.2546 0.1741 ( 518 PWs) bands (ev): -11.7120 -11.7120 1.0371 1.0371 1.5322 1.5322 2.6432 2.6432 12.4937 12.4937 15.6271 15.6271 16.0382 16.0382 19.0107 19.0107 k = 0.2027-0.2634 0.1801 ( 518 PWs) bands (ev): -11.6481 -11.6481 0.8657 0.8657 1.6040 1.6040 2.5700 2.5700 12.5717 12.5717 15.6123 15.6123 15.8830 15.8830 19.2158 19.2158 k = 0.2095-0.2721 0.1861 ( 518 PWs) bands (ev): -11.5821 -11.5821 0.6924 0.6924 1.6779 1.6779 2.4971 2.4971 12.6523 12.6523 15.5962 15.5962 15.7253 15.7253 19.4243 19.4243 k = 0.2162-0.2809 0.1921 ( 516 PWs) bands (ev): -11.5139 -11.5139 0.5177 0.5177 1.7542 1.7542 2.4246 2.4246 12.7355 12.7355 15.5653 15.5653 15.5793 15.5793 19.6361 19.6361 k = 0.2230-0.2897 0.1981 ( 520 PWs) bands (ev): -11.4437 -11.4437 0.3415 0.3415 1.8325 1.8325 2.3522 2.3522 12.8212 12.8212 15.4032 15.4032 15.5609 15.5609 19.8508 19.8508 k = 0.2297-0.2985 0.2041 ( 520 PWs) bands (ev): -11.3714 -11.3714 0.1641 0.1641 1.9130 1.9130 2.2809 2.2809 12.9095 12.9095 15.2392 15.2392 15.5420 15.5420 20.0684 20.0684 k = 0.2365-0.3072 0.2102 ( 520 PWs) bands (ev): -11.2969 -11.2969 -0.0144 -0.0144 1.9956 1.9956 2.2103 2.2103 13.0002 13.0002 15.0733 15.0733 15.5224 15.5224 20.2886 20.2886 k = 0.2432-0.3160 0.2162 ( 516 PWs) bands (ev): -11.2204 -11.2204 -0.1937 -0.1937 2.0803 2.0803 2.1408 2.1408 13.0935 13.0935 14.9059 14.9059 15.5024 15.5024 20.5113 20.5113 k = 0.2500-0.3248 0.2222 ( 520 PWs) bands (ev): -11.1419 -11.1419 -0.3739 -0.3739 2.0720 2.0720 2.1670 2.1670 13.1892 13.1892 14.7367 14.7367 15.4819 15.4819 20.7361 20.7361 k = 0.2568-0.3336 0.2282 ( 520 PWs) bands (ev): -11.0612 -11.0612 -0.5546 -0.5546 2.0043 2.0043 2.2558 2.2558 13.2873 13.2873 14.5665 14.5665 15.4610 15.4610 20.9627 20.9627 k = 0.2635-0.3424 0.2342 ( 520 PWs) bands (ev): -10.9785 -10.9785 -0.7358 -0.7358 1.9377 1.9377 2.3465 2.3465 13.3877 13.3877 14.3951 14.3951 15.4401 15.4401 21.1911 21.1911 k = 0.2703-0.3511 0.2402 ( 520 PWs) bands (ev): -10.8938 -10.8938 -0.9173 -0.9173 1.8723 1.8723 2.4391 2.4391 13.4905 13.4905 14.2227 14.2227 15.4191 15.4191 21.4210 21.4210 k = 0.2770-0.3599 0.2462 ( 520 PWs) bands (ev): -10.8070 -10.8070 -1.0991 -1.0991 1.8082 1.8082 2.5336 2.5336 13.5956 13.5956 14.0495 14.0495 15.3982 15.3982 21.6521 21.6521 k = 0.2838-0.3687 0.2522 ( 520 PWs) bands (ev): -10.7182 -10.7182 -1.2810 -1.2810 1.7454 1.7454 2.6299 2.6299 13.7027 13.7027 13.8757 13.8757 15.3777 15.3777 21.8841 21.8841 k = 0.2905-0.3775 0.2582 ( 522 PWs) bands (ev): -10.6274 -10.6274 -1.4631 -1.4631 1.6841 1.6841 2.7279 2.7279 13.7015 13.7015 13.8119 13.8119 15.3577 15.3577 22.1169 22.1169 k = 0.2973-0.3862 0.2642 ( 526 PWs) bands (ev): -10.5346 -10.5346 -1.6449 -1.6449 1.6241 1.6241 2.8276 2.8276 13.5269 13.5269 13.9230 13.9230 15.3383 15.3383 22.3499 22.3499 k = 0.3041-0.3950 0.2702 ( 522 PWs) bands (ev): -10.4398 -10.4398 -1.8265 -1.8265 1.5657 1.5657 2.9289 2.9289 13.3523 13.3523 14.0357 14.0357 15.3202 15.3202 22.4048 22.4048 k = 0.3108-0.4038 0.2762 ( 522 PWs) bands (ev): -10.3431 -10.3431 -2.0077 -2.0077 1.5089 1.5089 3.0318 3.0318 13.1776 13.1776 14.1496 14.1496 15.3034 15.3034 22.3886 22.3886 k = 0.3176-0.4126 0.2822 ( 522 PWs) bands (ev): -10.2443 -10.2443 -2.1886 -2.1886 1.4536 1.4536 3.1360 3.1360 13.0032 13.0032 14.2643 14.2643 15.2886 15.2886 22.3592 22.3592 k = 0.3243-0.4214 0.2882 ( 522 PWs) bands (ev): -10.1437 -10.1437 -2.3690 -2.3690 1.4001 1.4001 3.2416 3.2416 12.8292 12.8292 14.3790 14.3790 15.2767 15.2767 22.3165 22.3165 k = 0.3311-0.4301 0.2942 ( 522 PWs) bands (ev): -10.0411 -10.0411 -2.5488 -2.5488 1.3482 1.3482 3.3485 3.3485 12.6558 12.6558 14.4922 14.4922 15.2691 15.2691 22.2605 22.2605 k = 0.3378-0.4389 0.3002 ( 522 PWs) bands (ev): -9.9366 -9.9366 -2.7279 -2.7279 1.2982 1.2982 3.4564 3.4564 12.4833 12.4833 14.6018 14.6018 15.2680 15.2680 22.1914 22.1914 k = 0.3446-0.4477 0.3062 ( 526 PWs) bands (ev): -9.8302 -9.8302 -2.9067 -2.9067 1.2498 1.2498 3.5652 3.5652 12.3118 12.3118 14.7039 14.7039 15.2772 15.2772 22.1098 22.1098 k = 0.3514-0.4565 0.3122 ( 530 PWs) bands (ev): -9.7220 -9.7220 -3.0843 -3.0843 1.2032 1.2032 3.6749 3.6749 12.1416 12.1416 14.7928 14.7928 15.3025 15.3025 22.0161 22.0161 k = 0.3581-0.4653 0.3182 ( 530 PWs) bands (ev): -9.6120 -9.6120 -3.2610 -3.2610 1.1585 1.1585 3.7852 3.7852 11.9729 11.9729 14.8619 14.8619 15.3507 15.3507 21.9113 21.9113 k = 0.3649-0.4740 0.3242 ( 530 PWs) bands (ev): -9.5002 -9.5002 -3.4366 -3.4366 1.1158 1.1158 3.8959 3.8959 11.8061 11.8061 14.9078 14.9078 15.4251 15.4251 21.7960 21.7960 k = 0.3716-0.4828 0.3302 ( 530 PWs) bands (ev): -9.3866 -9.3866 -3.6112 -3.6112 1.0750 1.0750 4.0068 4.0068 11.6413 11.6413 14.9333 14.9333 15.5229 15.5229 21.6713 21.6713 k = 0.3784-0.4916 0.3362 ( 532 PWs) bands (ev): -9.2713 -9.2713 -3.7848 -3.7848 1.0361 1.0361 4.1177 4.1177 11.4789 11.4789 14.9447 14.9447 15.6377 15.6377 21.5380 21.5380 k = 0.3851-0.5004 0.3423 ( 532 PWs) bands (ev): -9.1544 -9.1544 -3.9569 -3.9569 0.9992 0.9992 4.2282 4.2282 11.3194 11.3194 14.9475 14.9475 15.7643 15.7643 21.3971 21.3971 k = 0.3919-0.5091 0.3483 ( 528 PWs) bands (ev): -9.0358 -9.0358 -4.1277 -4.1277 0.9643 0.9643 4.3380 4.3380 11.1630 11.1630 14.9452 14.9452 15.8988 15.8988 21.2498 21.2498 k = 0.3986-0.5179 0.3543 ( 528 PWs) bands (ev): -8.9158 -8.9158 -4.2969 -4.2969 0.9313 0.9313 4.4468 4.4468 11.0102 11.0102 14.9401 14.9401 16.0393 16.0393 21.0963 21.0963 k = 0.4054-0.5267 0.3603 ( 528 PWs) bands (ev): -8.7943 -8.7943 -4.4646 -4.4646 0.9005 0.9005 4.5542 4.5542 10.8615 10.8615 14.9332 14.9332 16.1844 16.1844 20.9377 20.9377 k = 0.4122-0.5355 0.3663 ( 528 PWs) bands (ev): -8.6715 -8.6715 -4.6306 -4.6306 0.8717 0.8717 4.6595 4.6595 10.7173 10.7173 14.9256 14.9256 16.3332 16.3332 20.7747 20.7747 k = 0.4189-0.5443 0.3723 ( 530 PWs) bands (ev): -8.5476 -8.5476 -4.7946 -4.7946 0.8449 0.8449 4.7623 4.7623 10.5784 10.5784 14.9176 14.9176 16.4853 16.4853 20.6081 20.6081 k = 0.4257-0.5530 0.3783 ( 530 PWs) bands (ev): -8.4227 -8.4227 -4.9564 -4.9564 0.8203 0.8203 4.8621 4.8621 10.4454 10.4454 14.9096 14.9096 16.6402 16.6402 20.4386 20.4386 k = 0.4324-0.5618 0.3843 ( 530 PWs) bands (ev): -8.2971 -8.2971 -5.1158 -5.1158 0.7977 0.7977 4.9579 4.9579 10.3189 10.3189 14.9020 14.9020 16.7977 16.7977 20.2665 20.2665 k = 0.4392-0.5706 0.3903 ( 530 PWs) bands (ev): -8.1712 -8.1712 -5.2724 -5.2724 0.7772 0.7772 5.0491 5.0491 10.2000 10.2000 14.8947 14.8947 16.9575 16.9575 20.0926 20.0926 k = 0.4459-0.5794 0.3963 ( 530 PWs) bands (ev): -8.0454 -8.0454 -5.4257 -5.4257 0.7589 0.7589 5.1348 5.1348 10.0894 10.0894 14.8880 14.8880 17.1195 17.1195 19.9173 19.9173 k = 0.4527-0.5882 0.4023 ( 530 PWs) bands (ev): -7.9205 -7.9205 -5.5749 -5.5749 0.7427 0.7427 5.2140 5.2140 9.9881 9.9881 14.8819 14.8819 17.2833 17.2833 19.7410 19.7410 k = 0.4595-0.5969 0.4083 ( 526 PWs) bands (ev): -7.7973 -7.7973 -5.7190 -5.7190 0.7287 0.7287 5.2862 5.2862 9.8974 9.8974 14.8765 14.8765 17.4491 17.4491 19.5643 19.5643 k = 0.4662-0.6057 0.4143 ( 526 PWs) bands (ev): -7.6779 -7.6779 -5.8562 -5.8562 0.7168 0.7168 5.3493 5.3493 9.8180 9.8180 14.8719 14.8719 17.6160 17.6160 19.3875 19.3875 k = 0.4730-0.6145 0.4203 ( 526 PWs) bands (ev): -7.5647 -7.5647 -5.9840 -5.9840 0.7070 0.7070 5.4027 5.4027 9.7512 9.7512 14.8680 14.8680 17.7839 17.7839 19.2113 19.2113 k = 0.4797-0.6233 0.4263 ( 526 PWs) bands (ev): -7.4621 -7.4621 -6.0981 -6.0981 0.6994 0.6994 5.4455 5.4455 9.6980 9.6980 14.8650 14.8650 17.9519 17.9519 19.0368 19.0368 k = 0.4865-0.6320 0.4323 ( 530 PWs) bands (ev): -7.3766 -7.3766 -6.1917 -6.1917 0.6939 0.6939 5.4768 5.4768 9.6593 9.6593 14.8628 14.8628 18.1179 18.1179 18.8660 18.8660 k = 0.4932-0.6408 0.4383 ( 522 PWs) bands (ev): -7.3180 -7.3180 -6.2549 -6.2549 0.6906 0.6906 5.4960 5.4960 9.6358 9.6358 14.8616 14.8616 18.2735 18.2735 18.7077 18.7077 k = 0.5000-0.6496 0.4443 ( 520 PWs) bands (ev): -7.2969 -7.2969 -6.2776 -6.2776 0.6895 0.6895 5.5024 5.5024 9.6281 9.6281 14.8612 14.8612 18.3631 18.3631 18.6171 18.6171 k = 0.5000-0.6496 0.4443 ( 520 PWs) bands (ev): -7.2969 -7.2969 -6.2776 -6.2776 0.6895 0.6895 5.5024 5.5024 9.6281 9.6281 14.8612 14.8612 18.3631 18.3631 18.6171 18.6171 k = 0.5106-0.6440 0.4405 ( 522 PWs) bands (ev): -7.2967 -7.2967 -6.2774 -6.2774 0.6895 0.6895 5.5005 5.5005 9.6258 9.6258 14.8607 14.8607 18.3678 18.3678 18.6199 18.6199 k = 0.5213-0.6384 0.4367 ( 522 PWs) bands (ev): -7.2960 -7.2960 -6.2769 -6.2769 0.6893 0.6893 5.4948 5.4948 9.6195 9.6195 14.8593 14.8593 18.3821 18.3821 18.6283 18.6283 k = 0.5319-0.6329 0.4329 ( 522 PWs) bands (ev): -7.2948 -7.2948 -6.2759 -6.2759 0.6890 0.6890 5.4855 5.4855 9.6090 9.6090 14.8570 14.8570 18.4057 18.4057 18.6422 18.6422 k = 0.5426-0.6273 0.4291 ( 526 PWs) bands (ev): -7.2932 -7.2932 -6.2747 -6.2747 0.6885 0.6885 5.4721 5.4721 9.5942 9.5942 14.8537 14.8537 18.4387 18.4387 18.6615 18.6615 k = 0.5532-0.6217 0.4252 ( 526 PWs) bands (ev): -7.2910 -7.2910 -6.2730 -6.2730 0.6880 0.6880 5.4555 5.4555 9.5757 9.5757 14.8496 14.8496 18.4811 18.4811 18.6862 18.6862 k = 0.5638-0.6161 0.4214 ( 530 PWs) bands (ev): -7.2885 -7.2885 -6.2711 -6.2711 0.6873 0.6873 5.4354 5.4354 9.5533 9.5533 14.8445 14.8445 18.5325 18.5325 18.7161 18.7161 k = 0.5745-0.6106 0.4176 ( 530 PWs) bands (ev): -7.2855 -7.2855 -6.2687 -6.2687 0.6865 0.6865 5.4121 5.4121 9.5273 9.5273 14.8386 14.8386 18.5930 18.5930 18.7510 18.7510 k = 0.5851-0.6050 0.4138 ( 530 PWs) bands (ev): -7.2820 -7.2820 -6.2659 -6.2659 0.6856 0.6856 5.3856 5.3856 9.4979 9.4979 14.8319 14.8319 18.6624 18.6624 18.7907 18.7907 k = 0.5957-0.5994 0.4100 ( 530 PWs) bands (ev): -7.2780 -7.2780 -6.2629 -6.2629 0.6846 0.6846 5.3561 5.3561 9.4652 9.4652 14.8244 14.8244 18.7404 18.7404 18.8351 18.8351 k = 0.6064-0.5938 0.4062 ( 526 PWs) bands (ev): -7.2737 -7.2737 -6.2595 -6.2595 0.6837 0.6837 5.3238 5.3238 9.4296 9.4296 14.8161 14.8161 18.8269 18.8269 18.8838 18.8838 k = 0.6170-0.5882 0.4024 ( 524 PWs) bands (ev): -7.2690 -7.2690 -6.2558 -6.2558 0.6825 0.6825 5.2890 5.2890 9.3911 9.3911 14.8070 14.8070 18.9215 18.9215 18.9366 18.9366 k = 0.6277-0.5827 0.3985 ( 524 PWs) bands (ev): -7.2639 -7.2639 -6.2518 -6.2518 0.6812 0.6812 5.2517 5.2517 9.3501 9.3501 14.7973 14.7973 18.9932 18.9932 19.0242 19.0242 k = 0.6383-0.5771 0.3947 ( 524 PWs) bands (ev): -7.2584 -7.2584 -6.2476 -6.2476 0.6798 0.6798 5.2122 5.2122 9.3068 9.3068 14.7869 14.7869 19.0534 19.0534 19.1346 19.1346 k = 0.6489-0.5715 0.3909 ( 524 PWs) bands (ev): -7.2526 -7.2526 -6.2431 -6.2431 0.6784 0.6784 5.1709 5.1709 9.2615 9.2615 14.7759 14.7759 19.1169 19.1169 19.2524 19.2524 k = 0.6596-0.5659 0.3871 ( 524 PWs) bands (ev): -7.2465 -7.2465 -6.2383 -6.2383 0.6768 0.6768 5.1278 5.1278 9.2145 9.2145 14.7644 14.7644 19.1832 19.1832 19.3775 19.3775 k = 0.6702-0.5603 0.3833 ( 524 PWs) bands (ev): -7.2402 -7.2402 -6.2334 -6.2334 0.6752 0.6752 5.0832 5.0832 9.1660 9.1660 14.7523 14.7523 19.2522 19.2522 19.5095 19.5095 k = 0.6809-0.5548 0.3795 ( 524 PWs) bands (ev): -7.2335 -7.2335 -6.2282 -6.2282 0.6736 0.6736 5.0374 5.0374 9.1163 9.1163 14.7399 14.7399 19.3236 19.3236 19.6482 19.6482 k = 0.6915-0.5492 0.3756 ( 524 PWs) bands (ev): -7.2267 -7.2267 -6.2229 -6.2229 0.6719 0.6719 4.9906 4.9906 9.0656 9.0656 14.7271 14.7271 19.3969 19.3969 19.7932 19.7932 k = 0.7021-0.5436 0.3718 ( 526 PWs) bands (ev): -7.2196 -7.2196 -6.2174 -6.2174 0.6701 0.6701 4.9431 4.9431 9.0140 9.0140 14.7140 14.7140 19.4718 19.4718 19.9443 19.9443 k = 0.7128-0.5380 0.3680 ( 530 PWs) bands (ev): -7.2124 -7.2124 -6.2118 -6.2118 0.6683 0.6683 4.8947 4.8947 8.9621 8.9621 14.7006 14.7006 19.5481 19.5481 20.1012 20.1012 k = 0.7234-0.5325 0.3642 ( 530 PWs) bands (ev): -7.2051 -7.2051 -6.2061 -6.2061 0.6665 0.6665 4.8463 4.8463 8.9101 8.9101 14.6871 14.6871 19.6255 19.6255 20.2635 20.2635 k = 0.7340-0.5269 0.3604 ( 530 PWs) bands (ev): -7.1976 -7.1976 -6.2004 -6.2004 0.6647 0.6647 4.7979 4.7979 8.8582 8.8582 14.6735 14.6735 19.7035 19.7035 20.4309 20.4309 k = 0.7447-0.5213 0.3566 ( 530 PWs) bands (ev): -7.1900 -7.1900 -6.1946 -6.1946 0.6628 0.6628 4.7495 4.7495 8.8065 8.8065 14.6599 14.6599 19.7819 19.7819 20.6032 20.6032 k = 0.7553-0.5157 0.3528 ( 530 PWs) bands (ev): -7.1824 -7.1824 -6.1887 -6.1887 0.6610 0.6610 4.7015 4.7015 8.7553 8.7553 14.6463 14.6463 19.8604 19.8604 20.7801 20.7801 k = 0.7660-0.5101 0.3489 ( 530 PWs) bands (ev): -7.1748 -7.1748 -6.1828 -6.1828 0.6591 0.6591 4.6539 4.6539 8.7048 8.7048 14.6327 14.6327 19.9387 19.9387 20.9611 20.9611 k = 0.7766-0.5046 0.3451 ( 530 PWs) bands (ev): -7.1672 -7.1672 -6.1770 -6.1770 0.6573 0.6573 4.6071 4.6071 8.6551 8.6551 14.6193 14.6193 20.0163 20.0163 21.1460 21.1460 k = 0.7872-0.4990 0.3413 ( 530 PWs) bands (ev): -7.1597 -7.1597 -6.1712 -6.1712 0.6555 0.6555 4.5613 4.5613 8.6066 8.6066 14.6062 14.6062 20.0931 20.0931 21.3343 21.3343 k = 0.7979-0.4934 0.3375 ( 530 PWs) bands (ev): -7.1523 -7.1523 -6.1655 -6.1655 0.6537 0.6537 4.5165 4.5165 8.5593 8.5593 14.5933 14.5933 20.1687 20.1687 21.5258 21.5258 k = 0.8085-0.4878 0.3337 ( 530 PWs) bands (ev): -7.1450 -7.1450 -6.1599 -6.1599 0.6520 0.6520 4.4730 4.4730 8.5135 8.5135 14.5807 14.5807 20.2428 20.2428 21.7200 21.7200 k = 0.8191-0.4822 0.3299 ( 526 PWs) bands (ev): -7.1378 -7.1378 -6.1544 -6.1544 0.6503 0.6503 4.4310 4.4310 8.4692 8.4692 14.5685 14.5685 20.3150 20.3150 21.9166 21.9166 k = 0.8298-0.4767 0.3260 ( 530 PWs) bands (ev): -7.1309 -7.1309 -6.1491 -6.1491 0.6487 0.6487 4.3905 4.3905 8.4266 8.4266 14.5567 14.5567 20.3851 20.3851 22.1149 22.1149 k = 0.8404-0.4711 0.3222 ( 530 PWs) bands (ev): -7.1242 -7.1242 -6.1440 -6.1440 0.6471 0.6471 4.3517 4.3517 8.3859 8.3859 14.5454 14.5454 20.4528 20.4528 22.3147 22.3147 k = 0.8511-0.4655 0.3184 ( 520 PWs) bands (ev): -7.1177 -7.1177 -6.1389 -6.1389 0.6458 0.6458 4.3149 4.3149 8.3476 8.3476 14.5346 14.5346 20.5182 20.5182 22.5153 22.5153 k = 0.8617-0.4599 0.3146 ( 520 PWs) bands (ev): -7.1115 -7.1115 -6.1342 -6.1342 0.6443 0.6443 4.2800 4.2800 8.3111 8.3111 14.5244 14.5244 20.5802 20.5802 22.7161 22.7161 k = 0.8723-0.4544 0.3108 ( 516 PWs) bands (ev): -7.1057 -7.1057 -6.1297 -6.1297 0.6430 0.6430 4.2472 4.2472 8.2770 8.2770 14.5148 14.5148 20.6390 20.6390 22.9165 22.9165 k = 0.8830-0.4488 0.3070 ( 516 PWs) bands (ev): -7.1002 -7.1002 -6.1255 -6.1255 0.6417 0.6417 4.2166 4.2166 8.2451 8.2451 14.5058 14.5058 20.6942 20.6942 23.1154 23.1154 k = 0.8936-0.4432 0.3031 ( 516 PWs) bands (ev): -7.0951 -7.0951 -6.1217 -6.1217 0.6405 0.6405 4.1884 4.1884 8.2156 8.2156 14.4975 14.4975 20.7456 20.7456 23.3120 23.3120 k = 0.9043-0.4376 0.2993 ( 518 PWs) bands (ev): -7.0904 -7.0904 -6.1181 -6.1181 0.6394 0.6394 4.1624 4.1624 8.1888 8.1888 14.4898 14.4898 20.7928 20.7928 23.5052 23.5052 k = 0.9149-0.4320 0.2955 ( 518 PWs) bands (ev): -7.0861 -7.0861 -6.1148 -6.1148 0.6384 0.6384 4.1390 4.1390 8.1645 8.1645 14.4829 14.4829 20.8359 20.8359 23.6932 23.6932 k = 0.9255-0.4265 0.2917 ( 518 PWs) bands (ev): -7.0823 -7.0823 -6.1119 -6.1119 0.6375 0.6375 4.1182 4.1182 8.1429 8.1429 14.4768 14.4768 20.8744 20.8744 23.8741 23.8741 k = 0.9362-0.4209 0.2879 ( 518 PWs) bands (ev): -7.0790 -7.0790 -6.1094 -6.1094 0.6368 0.6368 4.1000 4.1000 8.1241 8.1241 14.4714 14.4714 20.9082 20.9082 24.0456 24.0456 k = 0.9468-0.4153 0.2841 ( 518 PWs) bands (ev): -7.0761 -7.0761 -6.1072 -6.1072 0.6361 0.6361 4.0846 4.0846 8.1081 8.1081 14.4669 14.4669 20.9371 20.9371 24.2045 24.2045 k = 0.9574-0.4097 0.2803 ( 518 PWs) bands (ev): -7.0737 -7.0737 -6.1054 -6.1054 0.6356 0.6356 4.0718 4.0718 8.0949 8.0949 14.4631 14.4631 20.9610 20.9610 24.3466 24.3466 k = 0.9681-0.4041 0.2764 ( 518 PWs) bands (ev): -7.0719 -7.0719 -6.1040 -6.1040 0.6352 0.6352 4.0619 4.0619 8.0846 8.0846 14.4602 14.4602 20.9797 20.9797 24.4668 24.4668 k = 0.9787-0.3986 0.2726 ( 518 PWs) bands (ev): -7.0705 -7.0705 -6.1030 -6.1030 0.6349 0.6349 4.0548 4.0548 8.0773 8.0773 14.4580 14.4580 20.9932 20.9932 24.5593 24.5593 k = 0.9894-0.3930 0.2688 ( 516 PWs) bands (ev): -7.0697 -7.0697 -6.1024 -6.1024 0.6348 0.6348 4.0505 4.0505 8.0730 8.0730 14.4568 14.4568 21.0014 21.0014 24.6180 24.6180 k = 1.0000-0.3874 0.2650 ( 520 PWs) bands (ev): -7.0695 -7.0695 -6.1022 -6.1022 0.6344 0.6344 4.0491 4.0491 8.0714 8.0714 14.4562 14.4562 21.0040 21.0040 24.6382 24.6382 k = 1.0000-0.3874 0.2650 ( 520 PWs) bands (ev): -7.0695 -7.0695 -6.1022 -6.1022 0.6344 0.6344 4.0491 4.0491 8.0714 8.0714 14.4562 14.4562 21.0040 21.0040 24.6382 24.6382 k = 0.9932-0.3786 0.2590 ( 514 PWs) bands (ev): -7.0910 -7.0910 -6.0790 -6.0790 0.6359 0.6359 4.0411 4.0411 8.0813 8.0813 14.4570 14.4570 21.0016 21.0016 24.6409 24.6409 k = 0.9865-0.3699 0.2530 ( 514 PWs) bands (ev): -7.1502 -7.1502 -6.0149 -6.0149 0.6391 0.6391 4.0176 4.0176 8.1107 8.1107 14.4589 14.4589 20.9939 20.9939 24.6490 24.6490 k = 0.9797-0.3611 0.2470 ( 514 PWs) bands (ev): -7.2363 -7.2363 -5.9209 -5.9209 0.6446 0.6446 3.9791 3.9791 8.1588 8.1588 14.4619 14.4619 20.9811 20.9811 24.6625 24.6625 k = 0.9730-0.3523 0.2410 ( 514 PWs) bands (ev): -7.3391 -7.3391 -5.8069 -5.8069 0.6522 0.6522 3.9267 3.9267 8.2246 8.2246 14.4662 14.4662 20.9634 20.9634 24.6813 24.6813 k = 0.9662-0.3435 0.2350 ( 514 PWs) bands (ev): -7.4518 -7.4518 -5.6796 -5.6796 0.6620 0.6620 3.8618 3.8618 8.3068 8.3068 14.4718 14.4718 20.9409 20.9409 24.7053 24.7053 k = 0.9595-0.3347 0.2290 ( 514 PWs) bands (ev): -7.5705 -7.5705 -5.5434 -5.5434 0.6739 0.6739 3.7857 3.7857 8.4039 8.4039 14.4785 14.4785 20.9138 20.9138 24.7344 24.7344 k = 0.9527-0.3260 0.2230 ( 518 PWs) bands (ev): -7.6924 -7.6924 -5.4007 -5.4007 0.6880 0.6880 3.6999 3.6999 8.5145 8.5145 14.4864 14.4864 20.8822 20.8822 24.7685 24.7685 k = 0.9459-0.3172 0.2170 ( 518 PWs) bands (ev): -7.8161 -7.8161 -5.2531 -5.2531 0.7042 0.7042 3.6058 3.6058 8.6372 8.6372 14.4956 14.4956 20.8465 20.8465 24.8074 24.8074 k = 0.9392-0.3084 0.2110 ( 520 PWs) bands (ev): -7.9405 -7.9405 -5.1016 -5.1016 0.7226 0.7226 3.5048 3.5048 8.7704 8.7704 14.5058 14.5058 20.8068 20.8068 24.8509 24.8509 k = 0.9324-0.2996 0.2049 ( 520 PWs) bands (ev): -8.0649 -8.0649 -4.9470 -4.9470 0.7432 0.7432 3.3980 3.3980 8.9132 8.9132 14.5173 14.5173 20.7635 20.7635 24.8990 24.8990 k = 0.9257-0.2909 0.1989 ( 520 PWs) bands (ev): -8.1888 -8.1888 -4.7897 -4.7897 0.7658 0.7658 3.2867 3.2867 9.0642 9.0642 14.5300 14.5300 20.7167 20.7167 24.9514 24.9514 k = 0.9189-0.2821 0.1929 ( 520 PWs) bands (ev): -8.3120 -8.3120 -4.6301 -4.6301 0.7905 0.7905 3.1715 3.1715 9.2226 9.2226 14.5438 14.5438 20.6667 20.6667 25.0082 25.0082 k = 0.9122-0.2733 0.1869 ( 516 PWs) bands (ev): -8.4342 -8.4342 -4.4681 -4.4681 0.8174 0.8174 3.0535 3.0535 9.3876 9.3876 14.5588 14.5588 20.6139 20.6139 25.0691 25.0691 k = 0.9054-0.2645 0.1809 ( 512 PWs) bands (ev): -8.5551 -8.5551 -4.3045 -4.3045 0.8463 0.8463 2.9332 2.9332 9.5584 9.5584 14.5748 14.5748 20.5584 20.5584 25.1340 25.1340 k = 0.8986-0.2557 0.1749 ( 516 PWs) bands (ev): -8.6748 -8.6748 -4.1392 -4.1392 0.8772 0.8772 2.8114 2.8114 9.7342 9.7342 14.5919 14.5919 20.5005 20.5005 25.2028 25.2028 k = 0.8919-0.2470 0.1689 ( 512 PWs) bands (ev): -8.7930 -8.7930 -3.9724 -3.9724 0.9104 0.9104 2.6884 2.6884 9.9145 9.9145 14.6102 14.6102 20.4405 20.4405 25.2755 25.2755 k = 0.8851-0.2382 0.1629 ( 516 PWs) bands (ev): -8.9098 -8.9098 -3.8042 -3.8042 0.9454 0.9454 2.5646 2.5646 10.0987 10.0987 14.6294 14.6294 20.3784 20.3784 25.1952 25.1952 k = 0.8784-0.2294 0.1569 ( 516 PWs) bands (ev): -9.0250 -9.0250 -3.6346 -3.6346 0.9824 0.9824 2.4407 2.4407 10.2866 10.2866 14.6496 14.6496 20.3147 20.3147 24.9884 24.9884 k = 0.8716-0.2206 0.1509 ( 516 PWs) bands (ev): -9.1384 -9.1384 -3.4638 -3.4638 1.0215 1.0215 2.3169 2.3169 10.4776 10.4776 14.6709 14.6709 20.2496 20.2496 24.7766 24.7766 k = 0.8649-0.2118 0.1449 ( 520 PWs) bands (ev): -9.2502 -9.2502 -3.2919 -3.2919 1.0624 1.0624 2.1934 2.1934 10.6714 10.6714 14.6930 14.6930 20.1832 20.1832 24.5601 24.5601 k = 0.8581-0.2031 0.1389 ( 520 PWs) bands (ev): -9.3603 -9.3603 -3.1189 -3.1189 1.1053 1.1053 2.0705 2.0705 10.8677 10.8677 14.7161 14.7161 20.1157 20.1157 24.3401 24.3401 k = 0.8514-0.1943 0.1329 ( 524 PWs) bands (ev): -9.4687 -9.4687 -2.9450 -2.9450 1.1501 1.1501 1.9484 1.9484 11.0661 11.0661 14.7400 14.7400 20.0473 20.0473 24.1167 24.1167 k = 0.8446-0.1855 0.1269 ( 524 PWs) bands (ev): -9.5751 -9.5751 -2.7701 -2.7701 1.1967 1.1967 1.8273 1.8273 11.2665 11.2665 14.7648 14.7648 19.9782 19.9782 23.8907 23.8907 k = 0.8378-0.1767 0.1209 ( 524 PWs) bands (ev): -9.6797 -9.6797 -2.5945 -2.5945 1.2452 1.2452 1.7074 1.7074 11.4685 11.4685 14.7905 14.7905 19.9085 19.9085 23.6624 23.6624 k = 0.8311-0.1680 0.1149 ( 522 PWs) bands (ev): -9.7825 -9.7825 -2.4181 -2.4181 1.2956 1.2956 1.5889 1.5889 11.6718 11.6718 14.8169 14.8169 19.8384 19.8384 23.4322 23.4322 k = 0.8243-0.1592 0.1089 ( 522 PWs) bands (ev): -9.8834 -9.8834 -2.2411 -2.2411 1.3476 1.3476 1.4717 1.4717 11.8764 11.8764 14.8440 14.8440 19.7681 19.7681 23.2005 23.2005 k = 0.8176-0.1504 0.1029 ( 522 PWs) bands (ev): -9.9824 -9.9824 -2.0635 -2.0635 1.3561 1.3561 1.4014 1.4014 12.0818 12.0818 14.8718 14.8718 19.6976 19.6976 22.9677 22.9677 k = 0.8108-0.1416 0.0969 ( 522 PWs) bands (ev): -10.0795 -10.0795 -1.8855 -1.8855 1.2423 1.2423 1.4568 1.4568 12.2880 12.2880 14.9001 14.9001 19.6272 19.6272 22.7341 22.7341 k = 0.8041-0.1328 0.0909 ( 522 PWs) bands (ev): -10.1746 -10.1746 -1.7071 -1.7071 1.1301 1.1301 1.5139 1.5139 12.4946 12.4946 14.9291 14.9291 19.5569 19.5569 22.5001 22.5001 k = 0.7973-0.1241 0.0849 ( 518 PWs) bands (ev): -10.2678 -10.2678 -1.5280 -1.5280 1.0198 1.0198 1.5725 1.5725 12.7016 12.7016 14.9585 14.9585 19.4869 19.4869 22.2660 22.2660 k = 0.7905-0.1153 0.0789 ( 522 PWs) bands (ev): -10.3591 -10.3591 -1.3492 -1.3492 0.9114 0.9114 1.6327 1.6327 12.9085 12.9085 14.9883 14.9883 19.4172 19.4172 22.0318 22.0318 k = 0.7838-0.1065 0.0728 ( 522 PWs) bands (ev): -10.4483 -10.4483 -1.1702 -1.1702 0.8050 0.8050 1.6943 1.6943 13.1154 13.1154 15.0185 15.0185 19.3481 19.3481 21.7983 21.7983 k = 0.7770-0.0977 0.0668 ( 522 PWs) bands (ev): -10.5356 -10.5356 -0.9913 -0.9913 0.7006 0.7006 1.7574 1.7574 13.3219 13.3219 15.0489 15.0489 19.2795 19.2795 21.5656 21.5656 k = 0.7703-0.0889 0.0608 ( 518 PWs) bands (ev): -10.6208 -10.6208 -0.8124 -0.8124 0.5985 0.5985 1.8218 1.8218 13.5279 13.5279 15.0796 15.0796 19.2120 19.2120 21.3339 21.3339 k = 0.7635-0.0802 0.0548 ( 518 PWs) bands (ev): -10.7041 -10.7041 -0.6339 -0.6339 0.4983 0.4983 1.8874 1.8874 13.7331 13.7331 15.1103 15.1103 19.1448 19.1448 21.1034 21.1034 k = 0.7568-0.0714 0.0488 ( 518 PWs) bands (ev): -10.7853 -10.7853 -0.4556 -0.4556 0.4003 0.4003 1.9543 1.9543 13.9374 13.9374 15.1410 15.1410 19.0786 19.0786 20.8744 20.8744 k = 0.7500-0.0626 0.0428 ( 522 PWs) bands (ev): -10.8646 -10.8646 -0.2779 -0.2779 0.3045 0.3045 2.0222 2.0222 14.1403 14.1403 15.1717 15.1717 19.0130 19.0130 20.6471 20.6471 k = 0.7432-0.0538 0.0368 ( 522 PWs) bands (ev): -10.9418 -10.9418 -0.1008 -0.1008 0.2110 0.2110 2.0912 2.0912 14.3419 14.3419 15.2022 15.2022 18.9487 18.9487 20.4218 20.4218 k = 0.7365-0.0451 0.0308 ( 522 PWs) bands (ev): -11.0170 -11.0170 0.0755 0.0755 0.1197 0.1197 2.1613 2.1613 14.5420 14.5420 15.2325 15.2325 18.8855 18.8855 20.1986 20.1986 k = 0.7297-0.0363 0.0248 ( 522 PWs) bands (ev): -11.0901 -11.0901 0.0308 0.0308 0.2510 0.2510 2.2321 2.2321 14.7402 14.7402 15.2623 15.2623 18.8234 18.8234 19.9779 19.9779 k = 0.7230-0.0275 0.0188 ( 520 PWs) bands (ev): -11.1612 -11.1612 -0.0557 -0.0557 0.4256 0.4256 2.3038 2.3038 14.9365 14.9365 15.2917 15.2917 18.7626 18.7626 19.7597 19.7597 k = 0.7162-0.0187 0.0128 ( 520 PWs) bands (ev): -11.2302 -11.2302 -0.1399 -0.1399 0.5988 0.5988 2.3761 2.3761 15.1303 15.1303 15.3205 15.3205 18.7030 18.7030 19.5444 19.5444 k = 0.7095-0.0099 0.0068 ( 520 PWs) bands (ev): -11.2971 -11.2971 -0.2217 -0.2217 0.7705 0.7705 2.4490 2.4490 15.3217 15.3217 15.3485 15.3485 18.6448 18.6448 19.3321 19.3321 k = 0.7027-0.0012 0.0008 ( 520 PWs) bands (ev): -11.3620 -11.3620 -0.3010 -0.3010 0.9407 0.9407 2.5223 2.5223 15.3757 15.3757 15.5103 15.5103 18.5880 18.5880 19.1231 19.1231 k = 0.6959 0.0076-0.0052 ( 520 PWs) bands (ev): -11.4248 -11.4248 -0.3779 -0.3779 1.1092 1.1092 2.5959 2.5959 15.4019 15.4019 15.6959 15.6959 18.5326 18.5326 18.9175 18.9175 k = 0.6892 0.0164-0.0112 ( 520 PWs) bands (ev): -11.4855 -11.4855 -0.4523 -0.4523 1.2756 1.2756 2.6697 2.6697 15.4270 15.4270 15.8783 15.8783 18.4788 18.4788 18.7156 18.7156 k = 0.6824 0.0252-0.0172 ( 520 PWs) bands (ev): -11.5441 -11.5441 -0.5243 -0.5243 1.4400 1.4400 2.7435 2.7435 15.4508 15.4508 16.0572 16.0572 18.4265 18.4265 18.5177 18.5177 k = 0.6757 0.0339-0.0232 ( 520 PWs) bands (ev): -11.6006 -11.6006 -0.5937 -0.5937 1.6019 1.6019 2.8173 2.8173 15.4734 15.4734 16.2323 16.2323 18.3235 18.3235 18.3761 18.3761 k = 0.6689 0.0427-0.0292 ( 520 PWs) bands (ev): -11.6550 -11.6550 -0.6607 -0.6607 1.7613 1.7613 2.8908 2.8908 15.4945 15.4945 16.4035 16.4035 18.1340 18.1340 18.3271 18.3271 k = 0.6622 0.0515-0.0352 ( 524 PWs) bands (ev): -11.7074 -11.7074 -0.7251 -0.7251 1.9177 1.9177 2.9636 2.9636 15.5139 15.5139 16.5704 16.5704 17.9480 17.9480 18.2799 18.2799 k = 0.6554 0.0603-0.0412 ( 524 PWs) bands (ev): -11.7576 -11.7576 -0.7869 -0.7869 2.0711 2.0711 3.0361 3.0361 15.5318 15.5318 16.7327 16.7327 17.7677 17.7677 18.2345 18.2345 k = 0.6486 0.0691-0.0472 ( 524 PWs) bands (ev): -11.8057 -11.8057 -0.8462 -0.8462 2.2212 2.2212 3.1078 3.1078 15.5479 15.5479 16.8903 16.8903 17.5925 17.5925 18.1911 18.1911 k = 0.6419 0.0778-0.0532 ( 524 PWs) bands (ev): -11.8517 -11.8517 -0.9030 -0.9030 2.3677 2.3677 3.1785 3.1785 15.5622 15.5622 17.0427 17.0427 17.4225 17.4225 18.1496 18.1496 k = 0.6351 0.0866-0.0592 ( 526 PWs) bands (ev): -11.8955 -11.8955 -0.9572 -0.9572 2.5102 2.5102 3.2481 3.2481 15.5746 15.5746 17.1894 17.1894 17.2581 17.2581 18.1103 18.1103 k = 0.6284 0.0954-0.0653 ( 526 PWs) bands (ev): -11.9373 -11.9373 -1.0087 -1.0087 2.6487 2.6487 3.3163 3.3163 15.5851 15.5851 17.0992 17.0992 17.3303 17.3303 18.0735 18.0735 k = 0.6216 0.1042-0.0713 ( 526 PWs) bands (ev): -11.9769 -11.9769 -1.0577 -1.0577 2.7826 2.7826 3.3830 3.3830 15.5937 15.5937 16.9465 16.9465 17.4644 17.4644 18.0396 18.0396 k = 0.6149 0.1130-0.0773 ( 526 PWs) bands (ev): -12.0144 -12.0144 -1.1041 -1.1041 2.9118 2.9118 3.4479 3.4479 15.6004 15.6004 16.7999 16.7999 17.5904 17.5904 18.0099 18.0099 k = 0.6081 0.1217-0.0833 ( 526 PWs) bands (ev): -12.0498 -12.0498 -1.1479 -1.1479 3.0360 3.0360 3.5108 3.5108 15.6053 15.6053 16.6599 16.6599 17.7046 17.7046 17.9877 17.9877 k = 0.6014 0.1305-0.0893 ( 526 PWs) bands (ev): -12.0830 -12.0830 -1.1890 -1.1890 3.1547 3.1547 3.5714 3.5714 15.6085 15.6085 16.5267 16.5267 17.7955 17.7955 17.9846 17.9846 k = 0.5946 0.1393-0.0953 ( 526 PWs) bands (ev): -12.1141 -12.1141 -1.2275 -1.2275 3.2678 3.2678 3.6296 3.6296 15.6100 15.6100 16.4004 16.4004 17.8375 17.8375 18.0257 18.0257 k = 0.5878 0.1481-0.1013 ( 526 PWs) bands (ev): -12.1431 -12.1431 -1.2634 -1.2634 3.3749 3.3749 3.6851 3.6851 15.6100 15.6100 16.2815 16.2815 17.8368 17.8368 18.1047 18.1047 k = 0.5811 0.1568-0.1073 ( 528 PWs) bands (ev): -12.1700 -12.1700 -1.2967 -1.2967 3.4754 3.4754 3.7376 3.7376 15.6083 15.6083 16.1701 16.1701 17.8219 17.8219 18.1930 18.1930 k = 0.5743 0.1656-0.1133 ( 528 PWs) bands (ev): -12.1947 -12.1947 -1.3273 -1.3273 3.5694 3.5694 3.7870 3.7870 15.6058 15.6058 16.0664 16.0664 17.8036 17.8036 18.2796 18.2796 k = 0.5676 0.1744-0.1193 ( 528 PWs) bands (ev): -12.2172 -12.2172 -1.3553 -1.3553 3.6565 3.6565 3.8330 3.8330 15.6025 15.6025 15.9709 15.9709 17.7851 17.7851 18.3610 18.3610 k = 0.5608 0.1832-0.1253 ( 522 PWs) bands (ev): -12.2376 -12.2376 -1.3805 -1.3805 3.7366 3.7366 3.8755 3.8755 15.5986 15.5986 15.8836 15.8836 17.7677 17.7677 18.4365 18.4365 k = 0.5541 0.1920-0.1313 ( 522 PWs) bands (ev): -12.2558 -12.2558 -1.4032 -1.4032 3.8089 3.8089 3.9141 3.9141 15.5942 15.5942 15.8048 15.8048 17.7515 17.7515 18.5044 18.5044 k = 0.5473 0.2007-0.1373 ( 522 PWs) bands (ev): -12.2719 -12.2719 -1.4232 -1.4232 3.8733 3.8733 3.9487 3.9487 15.5895 15.5895 15.7347 15.7347 17.7370 17.7370 18.5650 18.5650 k = 0.5405 0.2095-0.1433 ( 522 PWs) bands (ev): -12.2859 -12.2859 -1.4405 -1.4405 3.9296 3.9296 3.9792 3.9792 15.5848 15.5848 15.6736 15.6736 17.7243 17.7243 18.6179 18.6179 k = 0.5338 0.2183-0.1493 ( 522 PWs) bands (ev): -12.2977 -12.2977 -1.4552 -1.4552 3.9774 3.9774 4.0055 4.0055 15.5803 15.5803 15.6217 15.6217 17.7134 17.7134 18.6629 18.6629 k = 0.5270 0.2271-0.1553 ( 518 PWs) bands (ev): -12.3074 -12.3074 -1.4671 -1.4671 4.0159 4.0159 4.0286 4.0286 15.5742 15.5742 15.5821 15.5821 17.7046 17.7046 18.6998 18.6998 k = 0.5203 0.2359-0.1613 ( 522 PWs) bands (ev): -12.3149 -12.3149 -1.4765 -1.4765 4.0408 4.0408 4.0513 4.0513 15.5450 15.5450 15.5746 15.5746 17.6976 17.6976 18.7286 18.7286 k = 0.5135 0.2446-0.1673 ( 520 PWs) bands (ev): -12.3203 -12.3203 -1.4832 -1.4832 4.0543 4.0543 4.0725 4.0725 15.5212 15.5212 15.5723 15.5723 17.6926 17.6926 18.7493 18.7493 k = 0.5068 0.2534-0.1733 ( 520 PWs) bands (ev): -12.3235 -12.3235 -1.4872 -1.4872 4.0619 4.0619 4.0855 4.0855 15.5069 15.5069 15.5707 15.5707 17.6896 17.6896 18.7617 18.7617 k = 0.5000 0.2622-0.1793 ( 520 PWs) bands (ev): -12.3246 -12.3246 -1.4885 -1.4885 4.0644 4.0644 4.0899 4.0899 15.5021 15.5021 15.5702 15.5702 17.6886 17.6886 18.7659 18.7659 k = 0.5000 0.2622-0.1793 ( 520 PWs) bands (ev): -12.3246 -12.3246 -1.4885 -1.4885 4.0644 4.0644 4.0899 4.0899 15.5021 15.5021 15.5702 15.5702 17.6886 17.6886 18.7659 18.7659 k = 0.4894 0.2566-0.1755 ( 520 PWs) bands (ev): -12.3249 -12.3249 -1.4866 -1.4866 4.0645 4.0645 4.0899 4.0899 15.5022 15.5022 15.5702 15.5702 17.6768 17.6768 18.7657 18.7657 k = 0.4787 0.2510-0.1717 ( 520 PWs) bands (ev): -12.3260 -12.3260 -1.4811 -1.4811 4.0646 4.0646 4.0899 4.0899 15.5026 15.5026 15.5701 15.5701 17.6416 17.6416 18.7653 18.7653 k = 0.4681 0.2455-0.1679 ( 520 PWs) bands (ev): -12.3278 -12.3278 -1.4718 -1.4718 4.0648 4.0648 4.0898 4.0898 15.5031 15.5031 15.5699 15.5699 17.5839 17.5839 18.7645 18.7645 k = 0.4574 0.2399-0.1641 ( 520 PWs) bands (ev): -12.3303 -12.3303 -1.4589 -1.4589 4.0650 4.0650 4.0898 4.0898 15.5039 15.5039 15.5696 15.5696 17.5048 17.5048 18.7635 18.7635 k = 0.4468 0.2343-0.1603 ( 521 PWs) bands (ev): -12.3336 -12.3336 -1.4425 -1.4425 4.0654 4.0654 4.0897 4.0897 15.5049 15.5049 15.5692 15.5692 17.4058 17.4058 18.7621 18.7621 k = 0.4362 0.2287-0.1564 ( 519 PWs) bands (ev): -12.3375 -12.3375 -1.4225 -1.4225 4.0659 4.0659 4.0899 4.0899 15.5059 15.5059 15.5685 15.5685 17.2890 17.2890 18.7608 18.7608 k = 0.4255 0.2231-0.1526 ( 519 PWs) bands (ev): -12.3421 -12.3421 -1.3988 -1.3988 4.0664 4.0664 4.0898 4.0898 15.5073 15.5073 15.5679 15.5679 17.1563 17.1563 18.7589 18.7589 k = 0.4149 0.2176-0.1488 ( 527 PWs) bands (ev): -12.3473 -12.3473 -1.3718 -1.3718 4.0667 4.0667 4.0893 4.0893 15.5089 15.5089 15.5671 15.5671 17.0095 17.0095 18.7558 18.7558 k = 0.4043 0.2120-0.1450 ( 527 PWs) bands (ev): -12.3531 -12.3531 -1.3413 -1.3413 4.0673 4.0673 4.0891 4.0891 15.5107 15.5107 15.5664 15.5664 16.8506 16.8506 18.7533 18.7533 k = 0.3936 0.2064-0.1412 ( 527 PWs) bands (ev): -12.3594 -12.3594 -1.3076 -1.3076 4.0680 4.0680 4.0889 4.0889 15.5127 15.5127 15.5657 15.5657 16.6815 16.6815 18.7505 18.7505 k = 0.3830 0.2008-0.1374 ( 535 PWs) bands (ev): -12.3664 -12.3664 -1.2707 -1.2707 4.0683 4.0683 4.0882 4.0882 15.5144 15.5144 15.5642 15.5642 16.5036 16.5036 18.7475 18.7475 k = 0.3723 0.1952-0.1335 ( 529 PWs) bands (ev): -12.3737 -12.3737 -1.2306 -1.2306 4.0691 4.0691 4.0880 4.0880 15.5168 15.5168 15.5634 15.5634 16.3187 16.3187 18.7449 18.7449 k = 0.3617 0.1897-0.1297 ( 529 PWs) bands (ev): -12.3816 -12.3816 -1.1876 -1.1876 4.0699 4.0699 4.0878 4.0878 15.5193 15.5193 15.5625 15.5625 16.1281 16.1281 18.7414 18.7414 k = 0.3511 0.1841-0.1259 ( 529 PWs) bands (ev): -12.3899 -12.3899 -1.1417 -1.1417 4.0708 4.0708 4.0875 4.0875 15.5220 15.5220 15.5615 15.5615 15.9330 15.9330 18.7377 18.7377 k = 0.3404 0.1785-0.1221 ( 533 PWs) bands (ev): -12.3987 -12.3987 -1.0934 -1.0934 4.0716 4.0716 4.0873 4.0873 15.5248 15.5248 15.5604 15.5604 15.7341 15.7341 18.7338 18.7338 k = 0.3298 0.1729-0.1183 ( 533 PWs) bands (ev): -12.4077 -12.4077 -1.0423 -1.0423 4.0725 4.0725 4.0871 4.0871 15.5267 15.5267 15.5341 15.5341 15.5596 15.5596 18.7297 18.7297 k = 0.3191 0.1674-0.1145 ( 533 PWs) bands (ev): -12.4171 -12.4171 -0.9888 -0.9888 4.0734 4.0734 4.0869 4.0869 15.3310 15.3310 15.5308 15.5308 15.5584 15.5584 18.7255 18.7255 k = 0.3085 0.1618-0.1107 ( 533 PWs) bands (ev): -12.4266 -12.4266 -0.9331 -0.9331 4.0743 4.0743 4.0867 4.0867 15.1282 15.1282 15.5338 15.5338 15.5574 15.5574 18.7211 18.7211 k = 0.2979 0.1562-0.1068 ( 533 PWs) bands (ev): -12.4364 -12.4364 -0.8753 -0.8753 4.0752 4.0752 4.0866 4.0866 14.9255 14.9255 15.5370 15.5370 15.5564 15.5564 18.7166 18.7166 k = 0.2872 0.1506-0.1030 ( 533 PWs) bands (ev): -12.4464 -12.4464 -0.8157 -0.8157 4.0760 4.0760 4.0865 4.0865 14.7237 14.7237 15.5401 15.5401 15.5555 15.5555 18.7120 18.7120 k = 0.2766 0.1450-0.0992 ( 533 PWs) bands (ev): -12.4564 -12.4564 -0.7545 -0.7545 4.0767 4.0767 4.0866 4.0866 14.5234 14.5234 15.5431 15.5431 15.5547 15.5547 18.7073 18.7073 k = 0.2660 0.1395-0.0954 ( 533 PWs) bands (ev): -12.4666 -12.4666 -0.6918 -0.6918 4.0774 4.0774 4.0867 4.0867 14.3251 14.3251 15.5456 15.5456 15.5544 15.5544 18.7026 18.7026 k = 0.2553 0.1339-0.0916 ( 533 PWs) bands (ev): -12.4767 -12.4767 -0.6280 -0.6280 4.0778 4.0778 4.0870 4.0870 14.1294 14.1294 15.5473 15.5473 15.5551 15.5551 18.6978 18.6978 k = 0.2447 0.1283-0.0878 ( 531 PWs) bands (ev): -12.4868 -12.4868 -0.5631 -0.5631 4.0782 4.0782 4.0875 4.0875 13.9368 13.9368 15.5477 15.5477 15.5570 15.5570 18.6932 18.6932 k = 0.2340 0.1227-0.0839 ( 531 PWs) bands (ev): -12.4969 -12.4969 -0.4976 -0.4976 4.0784 4.0784 4.0881 4.0881 13.7479 13.7479 15.5472 15.5472 15.5598 15.5598 18.6884 18.6884 k = 0.2234 0.1171-0.0801 ( 531 PWs) bands (ev): -12.5068 -12.5068 -0.4317 -0.4317 4.0785 4.0785 4.0888 4.0888 13.5631 13.5631 15.5464 15.5464 15.5629 15.5629 18.6836 18.6836 k = 0.2128 0.1116-0.0763 ( 531 PWs) bands (ev): -12.5166 -12.5166 -0.3656 -0.3656 4.0785 4.0785 4.0896 4.0896 13.3829 13.3829 15.5455 15.5455 15.5661 15.5661 18.6788 18.6788 k = 0.2021 0.1060-0.0725 ( 531 PWs) bands (ev): -12.5262 -12.5262 -0.2997 -0.2997 4.0784 4.0784 4.0905 4.0905 13.2077 13.2077 15.5446 15.5446 15.5694 15.5694 18.6741 18.6741 k = 0.1915 0.1004-0.0687 ( 531 PWs) bands (ev): -12.5356 -12.5356 -0.2343 -0.2343 4.0782 4.0782 4.0914 4.0914 13.0379 13.0379 15.5436 15.5436 15.5726 15.5726 18.6695 18.6695 k = 0.1809 0.0948-0.0649 ( 531 PWs) bands (ev): -12.5447 -12.5447 -0.1696 -0.1696 4.0780 4.0780 4.0923 4.0923 12.8741 12.8741 15.5426 15.5426 15.5758 15.5758 18.6650 18.6650 k = 0.1702 0.0893-0.0611 ( 531 PWs) bands (ev): -12.5535 -12.5535 -0.1060 -0.1060 4.0778 4.0778 4.0933 4.0933 12.7167 12.7167 15.5417 15.5417 15.5789 15.5789 18.6607 18.6607 k = 0.1596 0.0837-0.0572 ( 531 PWs) bands (ev): -12.5619 -12.5619 -0.0438 -0.0438 4.0776 4.0776 4.0942 4.0942 12.5660 12.5660 15.5407 15.5407 15.5818 15.5818 18.6565 18.6565 k = 0.1489 0.0781-0.0534 ( 529 PWs) bands (ev): -12.5699 -12.5699 0.0167 0.0167 4.0774 4.0774 4.0951 4.0951 12.4225 12.4225 15.5399 15.5399 15.5848 15.5848 18.6524 18.6524 k = 0.1383 0.0725-0.0496 ( 529 PWs) bands (ev): -12.5775 -12.5775 0.0750 0.0750 4.0771 4.0771 4.0960 4.0960 12.2866 12.2866 15.5390 15.5390 15.5875 15.5875 18.6486 18.6486 k = 0.1277 0.0669-0.0458 ( 529 PWs) bands (ev): -12.5847 -12.5847 0.1308 0.1308 4.0769 4.0769 4.0968 4.0968 12.1587 12.1587 15.5382 15.5382 15.5901 15.5901 18.6449 18.6449 k = 0.1170 0.0614-0.0420 ( 529 PWs) bands (ev): -12.5914 -12.5914 0.1837 0.1837 4.0766 4.0766 4.0976 4.0976 12.0393 12.0393 15.5375 15.5375 15.5926 15.5926 18.6415 18.6415 k = 0.1064 0.0558-0.0382 ( 525 PWs) bands (ev): -12.5976 -12.5976 0.2336 0.2336 4.0764 4.0764 4.0984 4.0984 11.9287 11.9287 15.5369 15.5369 15.5951 15.5951 18.6384 18.6384 k = 0.0957 0.0502-0.0343 ( 525 PWs) bands (ev): -12.6033 -12.6033 0.2799 0.2799 4.0762 4.0762 4.0991 4.0991 11.8272 11.8272 15.5363 15.5363 15.5971 15.5971 18.6355 18.6355 k = 0.0851 0.0446-0.0305 ( 525 PWs) bands (ev): -12.6085 -12.6085 0.3224 0.3224 4.0760 4.0760 4.0997 4.0997 11.7354 11.7354 15.5357 15.5357 15.5990 15.5990 18.6328 18.6328 k = 0.0745 0.0390-0.0267 ( 521 PWs) bands (ev): -12.6131 -12.6131 0.3607 0.3607 4.0760 4.0760 4.1004 4.1004 11.6535 11.6535 15.5352 15.5352 15.6009 15.6009 18.6309 18.6309 k = 0.0638 0.0335-0.0229 ( 521 PWs) bands (ev): -12.6171 -12.6171 0.3945 0.3945 4.0758 4.0758 4.1009 4.1009 11.5817 11.5817 15.5348 15.5348 15.6023 15.6023 18.6288 18.6288 k = 0.0532 0.0279-0.0191 ( 525 PWs) bands (ev): -12.6205 -12.6205 0.4236 0.4236 4.0757 4.0757 4.1011 4.1011 11.5205 11.5205 15.5344 15.5344 15.6036 15.6036 18.6268 18.6268 k = 0.0426 0.0223-0.0153 ( 525 PWs) bands (ev): -12.6233 -12.6233 0.4478 0.4478 4.0756 4.0756 4.1014 4.1014 11.4701 11.4701 15.5341 15.5341 15.6046 15.6046 18.6254 18.6254 k = 0.0319 0.0167-0.0114 ( 525 PWs) bands (ev): -12.6255 -12.6255 0.4668 0.4668 4.0755 4.0755 4.1017 4.1017 11.4307 11.4307 15.5338 15.5338 15.6054 15.6054 18.6242 18.6242 k = 0.0213 0.0112-0.0076 ( 525 PWs) bands (ev): -12.6271 -12.6271 0.4805 0.4805 4.0754 4.0754 4.1019 4.1019 11.4023 11.4023 15.5336 15.5336 15.6060 15.6060 18.6234 18.6234 k = 0.0106 0.0056-0.0038 ( 525 PWs) bands (ev): -12.6281 -12.6281 0.4887 0.4887 4.0754 4.0754 4.1020 4.1020 11.3853 11.3853 15.5335 15.5335 15.6064 15.6064 18.6229 18.6229 k = 0.0000 0.0000 0.0000 ( 525 PWs) bands (ev): -12.6284 -12.6284 0.4915 0.4915 4.0754 4.0754 4.1020 4.1020 11.3796 11.3796 15.5335 15.5335 15.6065 15.6065 18.6227 18.6227 k = 0.0000 0.0000 0.0000 ( 525 PWs) bands (ev): -12.6284 -12.6284 0.4915 0.4915 4.0754 4.0754 4.1020 4.1020 11.3796 11.3796 15.5335 15.5335 15.6065 15.6065 18.6227 18.6227 k = 0.0000 0.0071 0.0104 ( 525 PWs) bands (ev): -12.6273 -12.6273 0.4928 0.4928 4.0729 4.0729 4.0976 4.0976 11.3809 11.3809 15.5382 15.5382 15.6073 15.6073 18.6184 18.6184 k = 0.0000 0.0142 0.0208 ( 525 PWs) bands (ev): -12.6240 -12.6240 0.4965 0.4965 4.0655 4.0655 4.0845 4.0845 11.3849 11.3849 15.5521 15.5521 15.6097 15.6097 18.6054 18.6054 k = 0.0000 0.0214 0.0312 ( 525 PWs) bands (ev): -12.6185 -12.6185 0.5028 0.5028 4.0523 4.0523 4.0634 4.0634 11.3915 11.3915 15.5752 15.5752 15.6139 15.6139 18.5839 18.5839 k = 0.0000 0.0285 0.0416 ( 521 PWs) bands (ev): -12.6108 -12.6108 0.5115 0.5115 4.0282 4.0282 4.0402 4.0402 11.4007 11.4007 15.6066 15.6066 15.6203 15.6203 18.5539 18.5539 k = 0.0000 0.0356 0.0520 ( 521 PWs) bands (ev): -12.6010 -12.6010 0.5228 0.5228 3.9900 3.9900 4.0175 4.0175 11.4126 11.4126 15.6257 15.6257 15.6493 15.6493 18.5153 18.5153 k = 0.0000 0.0427 0.0624 ( 521 PWs) bands (ev): -12.5889 -12.5889 0.5366 0.5366 3.9426 3.9426 3.9911 3.9911 11.4272 11.4272 15.6350 15.6350 15.6981 15.6981 18.4685 18.4685 k = 0.0000 0.0498 0.0729 ( 521 PWs) bands (ev): -12.5746 -12.5746 0.5528 0.5528 3.8869 3.8869 3.9603 3.9603 11.4443 11.4443 15.6457 15.6457 15.7552 15.7552 18.4134 18.4134 k = 0.0000 0.0570 0.0833 ( 517 PWs) bands (ev): -12.5582 -12.5582 0.5716 0.5716 3.8239 3.8239 3.9251 3.9251 11.4642 11.4642 15.6586 15.6586 15.8201 15.8201 18.3504 18.3504 k = 0.0000 0.0641 0.0937 ( 517 PWs) bands (ev): -12.5396 -12.5396 0.5928 0.5928 3.7531 3.7531 3.8853 3.8853 11.4867 11.4867 15.6727 15.6727 15.8917 15.8917 18.2795 18.2795 k = 0.0000 0.0712 0.1041 ( 517 PWs) bands (ev): -12.5187 -12.5187 0.6165 0.6165 3.6753 3.6753 3.8411 3.8411 11.5118 11.5118 15.6886 15.6886 15.9696 15.9696 18.2010 18.2010 k = 0.0000 0.0783 0.1145 ( 517 PWs) bands (ev): -12.4957 -12.4957 0.6427 0.6427 3.5910 3.5910 3.7926 3.7926 11.5396 11.5396 15.7063 15.7063 16.0534 16.0534 18.1151 18.1151 k = 0.0000 0.0854 0.1249 ( 521 PWs) bands (ev): -12.4706 -12.4706 0.6713 0.6713 3.5004 3.5004 3.7399 3.7399 11.5701 11.5701 15.7257 15.7257 16.1422 16.1422 18.0221 18.0221 k = 0.0000 0.0925 0.1353 ( 521 PWs) bands (ev): -12.4432 -12.4432 0.7024 0.7024 3.4041 3.4041 3.6830 3.6830 11.6033 11.6033 15.7472 15.7472 16.2355 16.2355 17.9222 17.9222 k = 0.0000 0.0997 0.1457 ( 525 PWs) bands (ev): -12.4137 -12.4137 0.7360 0.7360 3.3022 3.3022 3.6219 3.6219 11.6391 11.6391 15.7707 15.7707 16.3326 16.3326 17.8151 17.8151 k = 0.0000 0.1068 0.1561 ( 525 PWs) bands (ev): -12.3819 -12.3819 0.7720 0.7720 3.1954 3.1954 3.5570 3.5570 11.6776 11.6776 15.7962 15.7962 16.4328 16.4328 17.7022 17.7022 k = 0.0000 0.1139 0.1665 ( 525 PWs) bands (ev): -12.3480 -12.3480 0.8105 0.8105 3.0841 3.0841 3.4883 3.4883 11.7188 11.7188 15.8238 15.8238 16.5355 16.5355 17.5832 17.5832 k = 0.0000 0.1210 0.1769 ( 523 PWs) bands (ev): -12.3119 -12.3119 0.8514 0.8514 2.9686 2.9686 3.4159 3.4159 11.7627 11.7627 15.8538 15.8538 16.6401 16.6401 17.4584 17.4584 k = 0.0000 0.1281 0.1873 ( 523 PWs) bands (ev): -12.2737 -12.2737 0.8948 0.8948 2.8491 2.8491 3.3399 3.3399 11.8093 11.8093 15.8857 15.8857 16.7456 16.7456 17.3282 17.3282 k = 0.0000 0.1353 0.1978 ( 527 PWs) bands (ev): -12.2333 -12.2333 0.9405 0.9405 2.7256 2.7256 3.2602 3.2602 11.8585 11.8585 15.9195 15.9195 16.8517 16.8517 17.1926 17.1926 k = 0.0000 0.1424 0.2082 ( 527 PWs) bands (ev): -12.1907 -12.1907 0.9887 0.9887 2.5993 2.5993 3.1773 3.1773 11.9105 11.9105 15.9558 15.9558 16.9577 16.9577 17.0522 17.0522 k = 0.0000 0.1495 0.2186 ( 527 PWs) bands (ev): -12.1459 -12.1459 1.0392 1.0392 2.4702 2.4702 3.0913 3.0913 11.9651 11.9651 15.9944 15.9944 16.9072 16.9072 17.0632 17.0632 k = 0.0000 0.1566 0.2290 ( 527 PWs) bands (ev): -12.0990 -12.0990 1.0921 1.0921 2.3385 2.3385 3.0022 3.0022 12.0225 12.0225 16.0354 16.0354 16.7579 16.7579 17.1676 17.1676 k = 0.0000 0.1637 0.2394 ( 527 PWs) bands (ev): -12.0499 -12.0499 1.1474 1.1474 2.2045 2.2045 2.9101 2.9101 12.0825 12.0825 16.0786 16.0786 16.6046 16.6046 17.2706 17.2706 k = 0.0000 0.1709 0.2498 ( 525 PWs) bands (ev): -11.9987 -11.9987 1.2051 1.2051 2.0684 2.0684 2.8153 2.8153 12.1452 12.1452 16.1245 16.1245 16.4475 16.4475 17.3718 17.3718 k = 0.0000 0.1780 0.2602 ( 525 PWs) bands (ev): -11.9453 -11.9453 1.2650 1.2650 1.9306 1.9306 2.7178 2.7178 12.2107 12.2107 16.1726 16.1726 16.2870 16.2870 17.4710 17.4710 k = 0.0000 0.1851 0.2706 ( 525 PWs) bands (ev): -11.8898 -11.8898 1.3273 1.3273 1.7912 1.7912 2.6178 2.6178 12.2788 12.2788 16.1231 16.1231 16.2231 16.2231 17.5679 17.5679 k = 0.0000 0.1922 0.2810 ( 525 PWs) bands (ev): -11.8322 -11.8322 1.3919 1.3919 1.6505 1.6505 2.5154 2.5154 12.3496 12.3496 15.9565 15.9565 16.2761 16.2761 17.6624 17.6624 k = 0.0000 0.1993 0.2914 ( 525 PWs) bands (ev): -11.7724 -11.7724 1.4587 1.4587 1.5087 1.5087 2.4108 2.4108 12.4230 12.4230 15.7871 15.7871 16.3315 16.3315 17.7544 17.7544 k = 0.0000 0.2065 0.3018 ( 525 PWs) bands (ev): -11.7105 -11.7105 1.3660 1.3660 1.5279 1.5279 2.3041 2.3041 12.4992 12.4992 15.6153 15.6153 16.3894 16.3894 17.8440 17.8440 k = 0.0000 0.2136 0.3122 ( 525 PWs) bands (ev): -11.6465 -11.6465 1.2225 1.2225 1.5992 1.5992 2.1954 2.1954 12.5780 12.5780 15.4412 15.4412 16.4499 16.4499 17.9311 17.9311 k = 0.0000 0.2207 0.3226 ( 525 PWs) bands (ev): -11.5803 -11.5803 1.0784 1.0784 1.6728 1.6728 2.0849 2.0849 12.6595 12.6595 15.2652 15.2652 16.5129 16.5129 18.0158 18.0158 k = 0.0000 0.2278 0.3331 ( 525 PWs) bands (ev): -11.5121 -11.5121 0.9340 0.9340 1.7485 1.7485 1.9727 1.9727 12.7437 12.7437 15.0875 15.0875 16.5784 16.5784 18.0983 18.0983 k = 0.0000 0.2349 0.3435 ( 525 PWs) bands (ev): -11.4417 -11.4417 0.7892 0.7892 1.8264 1.8264 1.8590 1.8590 12.8305 12.8305 14.9082 14.9082 16.6464 16.6464 18.1785 18.1785 k = 0.0000 0.2420 0.3539 ( 525 PWs) bands (ev): -11.3693 -11.3693 0.6443 0.6443 1.7437 1.7437 1.9065 1.9065 12.9199 12.9199 14.7276 14.7276 16.7170 16.7170 18.2568 18.2568 k = 0.0000 0.2492 0.3643 ( 527 PWs) bands (ev): -11.2948 -11.2948 0.4994 0.4994 1.6272 1.6272 1.9886 1.9886 13.0120 13.0120 14.5457 14.5457 16.7903 16.7903 18.3333 18.3333 k = 0.0000 0.2563 0.3747 ( 527 PWs) bands (ev): -11.2182 -11.2182 0.3547 0.3547 1.5095 1.5095 2.0729 2.0729 13.1067 13.1067 14.3630 14.3630 16.8659 16.8659 18.4079 18.4079 k = 0.0000 0.2634 0.3851 ( 527 PWs) bands (ev): -11.1395 -11.1395 0.2101 0.2101 1.3908 1.3908 2.1592 2.1592 13.2040 13.2040 14.1795 14.1795 16.9442 16.9442 18.4811 18.4811 k = 0.0000 0.2705 0.3955 ( 529 PWs) bands (ev): -11.0587 -11.0587 0.0659 0.0659 1.2710 1.2710 2.2475 2.2475 13.3039 13.3039 13.9954 13.9954 17.0249 17.0249 18.5529 18.5529 k = 0.0000 0.2776 0.4059 ( 529 PWs) bands (ev): -10.9759 -10.9759 -0.0779 -0.0779 1.1505 1.1505 2.3378 2.3378 13.4064 13.4064 13.8109 13.8109 17.1082 17.1082 18.6234 18.6234 k = 0.0000 0.2848 0.4163 ( 529 PWs) bands (ev): -10.8911 -10.8911 -0.2212 -0.2212 1.0293 1.0293 2.4300 2.4300 13.5115 13.5115 13.6261 13.6261 17.1940 17.1940 18.6929 18.6929 k = 0.0000 0.2919 0.4267 ( 533 PWs) bands (ev): -10.8042 -10.8042 -0.3641 -0.3641 0.9073 0.9073 2.5242 2.5242 13.4412 13.4412 13.6191 13.6191 17.2822 17.2822 18.7615 18.7615 k = 0.0000 0.2990 0.4371 ( 533 PWs) bands (ev): -10.7153 -10.7153 -0.5061 -0.5061 0.7850 0.7850 2.6202 2.6202 13.2563 13.2563 13.7292 13.7292 17.3731 17.3731 18.8293 18.8293 k = 0.0000 0.3061 0.4475 ( 533 PWs) bands (ev): -10.6244 -10.6244 -0.6474 -0.6474 0.6623 0.6623 2.7181 2.7181 13.0715 13.0715 13.8419 13.8419 17.4664 17.4664 18.8964 18.8964 k = 0.0000 0.3132 0.4579 ( 529 PWs) bands (ev): -10.5314 -10.5314 -0.7877 -0.7877 0.5393 0.5393 2.8178 2.8178 12.8871 12.8871 13.9571 13.9571 17.5623 17.5623 18.9631 18.9631 k = 0.0000 0.3204 0.4684 ( 521 PWs) bands (ev): -10.4364 -10.4364 -0.9272 -0.9272 0.4162 0.4162 2.9192 2.9192 12.7030 12.7030 14.0747 14.0747 17.6606 17.6606 19.0296 19.0296 k = 0.0000 0.3275 0.4788 ( 521 PWs) bands (ev): -10.3396 -10.3396 -1.0658 -1.0658 0.2930 0.2930 3.0222 3.0222 12.5194 12.5194 14.1948 14.1948 17.7613 17.7613 19.0956 19.0956 k = 0.0000 0.3346 0.4892 ( 521 PWs) bands (ev): -10.2408 -10.2408 -1.2034 -1.2034 0.1698 0.1698 3.1269 3.1269 12.3364 12.3364 14.3173 14.3173 17.8645 17.8645 19.1613 19.1613 k = 0.0000 0.3417 0.4996 ( 521 PWs) bands (ev): -10.1400 -10.1400 -1.3400 -1.3400 0.0467 0.0467 3.2330 3.2330 12.1542 12.1542 14.4422 14.4422 17.9701 17.9701 19.2270 19.2270 k = 0.0000 0.3488 0.5100 ( 521 PWs) bands (ev): -10.0373 -10.0373 -1.4754 -1.4754 -0.0762 -0.0762 3.3407 3.3407 11.9727 11.9727 14.5695 14.5695 18.0780 18.0780 19.2927 19.2927 k = 0.0000 0.3559 0.5204 ( 521 PWs) bands (ev): -9.9327 -9.9327 -1.6097 -1.6097 -0.1989 -0.1989 3.4498 3.4498 11.7922 11.7922 14.6991 14.6991 18.1883 18.1883 19.3584 19.3584 k = 0.0000 0.3631 0.5308 ( 521 PWs) bands (ev): -9.8262 -9.8262 -1.7428 -1.7428 -0.3211 -0.3211 3.5603 3.5603 11.6126 11.6126 14.8310 14.8310 18.3010 18.3010 19.4243 19.4243 k = 0.0000 0.3702 0.5412 ( 521 PWs) bands (ev): -9.7179 -9.7179 -1.8747 -1.8747 -0.4429 -0.4429 3.6721 3.6721 11.4342 11.4342 14.9651 14.9651 18.4160 18.4160 19.4904 19.4904 k = 0.0000 0.3773 0.5516 ( 521 PWs) bands (ev): -9.6077 -9.6077 -2.0052 -2.0052 -0.5642 -0.5642 3.7851 3.7851 11.2569 11.2569 15.1014 15.1014 18.5333 18.5333 19.5567 19.5567 k = 0.0000 0.3844 0.5620 ( 521 PWs) bands (ev): -9.4957 -9.4957 -2.1345 -2.1345 -0.6848 -0.6848 3.8992 3.8992 11.0809 11.0809 15.2399 15.2399 18.6528 18.6528 19.6234 19.6234 k = 0.0000 0.3915 0.5724 ( 521 PWs) bands (ev): -9.3819 -9.3819 -2.2625 -2.2625 -0.8048 -0.8048 4.0143 4.0143 10.9062 10.9062 15.3805 15.3805 18.7745 18.7745 19.6905 19.6905 k = 0.0000 0.3987 0.5828 ( 525 PWs) bands (ev): -9.2663 -9.2663 -2.3892 -2.3892 -0.9241 -0.9241 4.1304 4.1304 10.7328 10.7328 15.5231 15.5231 18.8984 18.8984 19.7580 19.7580 k = 0.0000 0.4058 0.5933 ( 525 PWs) bands (ev): -9.1490 -9.1490 -2.5144 -2.5144 -1.0424 -1.0424 4.2473 4.2473 10.5609 10.5609 15.6677 15.6677 19.0245 19.0245 19.8261 19.8261 k = 0.0000 0.4129 0.6037 ( 525 PWs) bands (ev): -9.0300 -9.0300 -2.6381 -2.6381 -1.1597 -1.1597 4.3650 4.3650 10.3906 10.3906 15.8142 15.8142 19.1527 19.1527 19.8946 19.8946 k = 0.0000 0.4200 0.6141 ( 525 PWs) bands (ev): -8.9093 -8.9093 -2.7604 -2.7604 -1.2761 -1.2761 4.4833 4.4833 10.2218 10.2218 15.9624 15.9624 19.2830 19.2830 19.8269 19.8269 k = 0.0000 0.4271 0.6245 ( 525 PWs) bands (ev): -8.7870 -8.7870 -2.8812 -2.8812 -1.3914 -1.3914 4.6022 4.6022 10.0546 10.0546 16.1125 16.1125 19.4153 19.4153 19.6655 19.6655 k = 0.0000 0.4343 0.6349 ( 529 PWs) bands (ev): -8.6631 -8.6631 -3.0006 -3.0006 -1.5055 -1.5055 4.7214 4.7214 9.8889 9.8889 16.2641 16.2641 19.5088 19.5088 19.5495 19.5495 k = 0.0000 0.4414 0.6453 ( 529 PWs) bands (ev): -8.5377 -8.5377 -3.1184 -3.1184 -1.6184 -1.6184 4.8409 4.8409 9.7251 9.7251 16.4172 16.4172 19.3571 19.3571 19.6857 19.6857 k = 0.0000 0.4485 0.6557 ( 529 PWs) bands (ev): -8.4108 -8.4108 -3.2347 -3.2347 -1.7299 -1.7299 4.9606 4.9606 9.5632 9.5632 16.5717 16.5717 19.2104 19.2104 19.8238 19.8238 k = 0.0000 0.4556 0.6661 ( 527 PWs) bands (ev): -8.2824 -8.2824 -3.3494 -3.3494 -1.8400 -1.8400 5.0803 5.0803 9.4030 9.4030 16.7275 16.7275 19.0688 19.0688 19.9638 19.9638 k = 0.0000 0.4627 0.6765 ( 527 PWs) bands (ev): -8.1528 -8.1528 -3.4625 -3.4625 -1.9486 -1.9486 5.1998 5.1998 9.2447 9.2447 16.8843 16.8843 18.9325 18.9325 20.1055 20.1055 k = 0.0000 0.4699 0.6869 ( 531 PWs) bands (ev): -8.0218 -8.0218 -3.5742 -3.5742 -2.0558 -2.0558 5.3190 5.3190 9.0882 9.0882 17.0419 17.0419 18.8015 18.8015 20.2488 20.2488 k = 0.0000 0.4770 0.6973 ( 531 PWs) bands (ev): -7.8897 -7.8897 -3.6842 -3.6842 -2.1611 -2.1611 5.4378 5.4378 8.9338 8.9338 17.2002 17.2002 18.6762 18.6762 20.3938 20.3938 k = 0.0000 0.4841 0.7077 ( 527 PWs) bands (ev): -7.7564 -7.7564 -3.7924 -3.7924 -2.2646 -2.2646 5.5559 5.5559 8.7814 8.7814 17.3589 17.3589 18.5565 18.5565 20.5403 20.5403 k = 0.0000 0.4912 0.7181 ( 527 PWs) bands (ev): -7.6222 -7.6222 -3.8991 -3.8991 -2.3662 -2.3662 5.6733 5.6733 8.6310 8.6310 17.5177 17.5177 18.4426 18.4426 20.6874 20.6874 k = 0.0000 0.4983 0.7286 ( 527 PWs) bands (ev): -7.4871 -7.4871 -4.0041 -4.0041 -2.4657 -2.4657 5.7896 5.7896 8.4826 8.4826 17.6764 17.6764 18.3348 18.3348 20.7715 20.7715 k = 0.0000 0.5054 0.7390 ( 527 PWs) bands (ev): -7.3513 -7.3513 -4.1075 -4.1075 -2.5630 -2.5630 5.9048 5.9048 8.3364 8.3364 17.8344 17.8344 18.2330 18.2330 20.8499 20.8499 k = 0.0000 0.5126 0.7494 ( 527 PWs) bands (ev): -7.2149 -7.2149 -4.2091 -4.2091 -2.6579 -2.6579 6.0186 6.0186 8.1923 8.1923 17.9914 17.9914 18.1376 18.1376 20.9293 20.9293 k = 0.0000 0.5197 0.7598 ( 527 PWs) bands (ev): -7.0782 -7.0782 -4.3091 -4.3091 -2.7502 -2.7502 6.1308 6.1308 8.0503 8.0503 18.0486 18.0486 18.1470 18.1470 21.0096 21.0096 k = 0.0000 0.5268 0.7702 ( 527 PWs) bands (ev): -6.9412 -6.9412 -4.4076 -4.4076 -2.8399 -2.8399 6.2415 6.2415 7.9105 7.9105 17.9663 17.9663 18.3005 18.3005 21.0909 21.0909 k = 0.0000 0.5339 0.7806 ( 523 PWs) bands (ev): -6.8045 -6.8045 -4.5042 -4.5042 -2.9263 -2.9263 6.3500 6.3500 7.7729 7.7729 17.8907 17.8907 18.4512 18.4512 21.1736 21.1736 k = 0.0000 0.5410 0.7910 ( 521 PWs) bands (ev): -6.6682 -6.6682 -4.5991 -4.5991 -3.0093 -3.0093 6.4564 6.4564 7.6376 7.6376 17.8220 17.8220 18.5984 18.5984 21.2569 21.2569 k = 0.0000 0.5482 0.8014 ( 525 PWs) bands (ev): -6.5329 -6.5329 -4.6924 -4.6924 -3.0886 -3.0886 6.5603 6.5603 7.5041 7.5041 17.7603 17.7603 18.7413 18.7413 21.3409 21.3409 k = 0.0000 0.5553 0.8118 ( 525 PWs) bands (ev): -6.3990 -6.3990 -4.7839 -4.7839 -3.1636 -3.1636 6.6617 6.6617 7.3733 7.3733 17.7060 17.7060 18.8787 18.8787 21.4261 21.4261 k = 0.0000 0.5624 0.8222 ( 529 PWs) bands (ev): -6.2671 -6.2671 -4.8736 -4.8736 -3.2338 -3.2338 6.7603 6.7603 7.2448 7.2448 17.6590 17.6590 19.0091 19.0091 21.5123 21.5123 k = 0.0000 0.5695 0.8326 ( 529 PWs) bands (ev): -6.1379 -6.1379 -4.9615 -4.9615 -3.2984 -3.2984 6.8560 6.8560 7.1187 7.1187 17.6194 17.6194 19.1320 19.1320 21.5996 21.5996 k = 0.0000 0.5766 0.8430 ( 529 PWs) bands (ev): -6.0124 -6.0124 -5.0478 -5.0478 -3.3566 -3.3566 6.9486 6.9486 6.9948 6.9948 17.5875 17.5875 19.2456 19.2456 21.6879 21.6879 k = 0.0000 0.5838 0.8534 ( 525 PWs) bands (ev): -5.8915 -5.8915 -5.1322 -5.1322 -3.4072 -3.4072 6.8734 6.8734 7.0378 7.0378 17.5634 17.5634 19.3481 19.3481 21.7773 21.7773 k = 0.0000 0.5909 0.8639 ( 525 PWs) bands (ev): -5.7767 -5.7767 -5.2149 -5.2149 -3.4491 -3.4491 6.7544 6.7544 7.1236 7.1236 17.5470 17.5470 19.4380 19.4380 21.8678 21.8678 k = 0.0000 0.5980 0.8743 ( 525 PWs) bands (ev): -5.6695 -5.6695 -5.2959 -5.2959 -3.4808 -3.4808 6.6377 6.6377 7.2058 7.2058 17.5385 17.5385 19.5134 19.5134 21.9593 21.9593 k = 0.0000 0.6051 0.8847 ( 525 PWs) bands (ev): -5.5715 -5.5715 -5.3750 -5.3750 -3.5005 -3.5005 6.5234 6.5234 7.2842 7.2842 17.5379 17.5379 19.5724 19.5724 22.0519 22.0519 k = 0.0000 0.6122 0.8951 ( 525 PWs) bands (ev): -5.4847 -5.4847 -5.4524 -5.4524 -3.5067 -3.5067 6.4116 6.4116 7.3587 7.3587 17.5452 17.5452 19.6135 19.6135 22.1456 22.1456 k = 0.0000 0.6194 0.9055 ( 531 PWs) bands (ev): -5.5282 -5.5282 -5.4104 -5.4104 -3.4975 -3.4975 6.3022 6.3022 7.4293 7.4293 17.5605 17.5605 19.6349 19.6349 22.2401 22.2401 k = 0.0000 0.6265 0.9159 ( 531 PWs) bands (ev): -5.6020 -5.6020 -5.3504 -5.3504 -3.4718 -3.4718 6.1953 6.1953 7.4959 7.4959 17.5836 17.5836 19.6359 19.6359 22.3360 22.3360 k = 0.0000 0.6336 0.9263 ( 531 PWs) bands (ev): -5.6741 -5.6741 -5.3051 -5.3051 -3.4291 -3.4291 6.0909 6.0909 7.5585 7.5585 17.6146 17.6146 19.6156 19.6156 22.4331 22.4331 k = 0.0000 0.6407 0.9367 ( 531 PWs) bands (ev): -5.7443 -5.7443 -5.2744 -5.2744 -3.3695 -3.3695 5.9889 5.9889 7.6171 7.6171 17.6532 17.6532 19.5739 19.5739 22.5312 22.5312 k = 0.0000 0.6478 0.9471 ( 531 PWs) bands (ev): -5.8129 -5.8129 -5.2573 -5.2573 -3.2939 -3.2939 5.8892 5.8892 7.6716 7.6716 17.6994 17.6994 19.5112 19.5112 22.6310 22.6310 k = 0.0000 0.6549 0.9575 ( 531 PWs) bands (ev): -5.8795 -5.8795 -5.2525 -5.2525 -3.2041 -3.2041 5.7923 5.7923 7.7221 7.7221 17.7530 17.7530 19.4283 19.4283 22.7314 22.7314 k = 0.0000 0.6621 0.9679 ( 531 PWs) bands (ev): -5.9444 -5.9444 -5.2581 -5.2581 -3.1019 -3.1019 5.6980 5.6980 7.7687 7.7687 17.8138 17.8138 19.3265 19.3265 22.8329 22.8329 k = 0.0000 0.6692 0.9783 ( 526 PWs) bands (ev): -6.0075 -6.0075 -5.2721 -5.2721 -2.9892 -2.9892 5.6061 5.6061 7.8114 7.8114 17.8816 17.8816 19.2075 19.2075 22.9363 22.9363 k = 0.0000 0.6692 0.9783 ( 526 PWs) bands (ev): -6.0075 -6.0075 -5.2721 -5.2721 -2.9892 -2.9892 5.6061 5.6061 7.8114 7.8114 17.8816 17.8816 19.2075 19.2075 22.9363 22.9363 k = 0.0058 0.6581 0.9783 ( 530 PWs) bands (ev): -5.9928 -5.9928 -5.2482 -5.2482 -3.0443 -3.0443 5.6433 5.6433 7.7992 7.7992 17.8486 17.8486 19.2694 19.2694 22.8677 22.8677 k = 0.0116 0.6470 0.9783 ( 531 PWs) bands (ev): -6.0071 -6.0071 -5.1977 -5.1977 -3.0924 -3.0924 5.6648 5.6648 7.8032 7.8032 17.8207 17.8207 19.3288 19.3288 22.7666 22.7666 k = 0.0174 0.6359 0.9783 ( 527 PWs) bands (ev): -6.0428 -6.0428 -5.1299 -5.1299 -3.1321 -3.1321 5.6710 5.6710 7.8230 7.8230 17.7980 17.7980 19.3857 19.3857 22.6344 22.6344 k = 0.0233 0.6248 0.9783 ( 527 PWs) bands (ev): -6.0921 -6.0921 -5.0541 -5.0541 -3.1621 -3.1621 5.6627 5.6627 7.8572 7.8572 17.7808 17.7808 19.4399 19.4399 22.4752 22.4752 k = 0.0291 0.6137 0.9783 ( 529 PWs) bands (ev): -6.1494 -6.1494 -4.9775 -4.9775 -3.1804 -3.1804 5.6414 5.6414 7.9041 7.9041 17.7694 17.7694 19.4913 19.4913 22.2939 22.2939 k = 0.0349 0.6027 0.9783 ( 527 PWs) bands (ev): -6.2113 -6.2113 -4.9057 -4.9057 -3.1853 -3.1853 5.6092 5.6092 7.9617 7.9617 17.7640 17.7640 19.5398 19.5398 22.0952 22.0952 k = 0.0407 0.5916 0.9783 ( 527 PWs) bands (ev): -6.2756 -6.2756 -4.8426 -4.8426 -3.1750 -3.1750 5.5677 5.5677 8.0278 8.0278 17.7649 17.7649 19.5853 19.5853 21.8830 21.8830 k = 0.0465 0.5805 0.9783 ( 527 PWs) bands (ev): -6.3410 -6.3410 -4.7909 -4.7909 -3.1482 -3.1482 5.5190 5.5190 8.1005 8.1005 17.7723 17.7723 19.6278 19.6278 21.6603 21.6603 k = 0.0523 0.5694 0.9783 ( 526 PWs) bands (ev): -6.4068 -6.4068 -4.7521 -4.7521 -3.1041 -3.1041 5.4645 5.4645 8.1781 8.1781 17.7863 17.7863 19.6672 19.6672 21.4298 21.4298 k = 0.0581 0.5583 0.9783 ( 526 PWs) bands (ev): -6.4721 -6.4721 -4.7269 -4.7269 -3.0431 -3.0431 5.4058 5.4058 8.2586 8.2586 17.8072 17.8072 19.7035 19.7035 21.1934 21.1934 k = 0.0640 0.5472 0.9783 ( 525 PWs) bands (ev): -6.5367 -6.5367 -4.7142 -4.7142 -2.9662 -2.9662 5.3439 5.3439 8.3408 8.3408 17.8350 17.8350 19.7365 19.7365 20.9525 20.9525 k = 0.0698 0.5361 0.9783 ( 523 PWs) bands (ev): -6.6004 -6.6004 -4.7129 -4.7129 -2.8754 -2.8754 5.2799 5.2799 8.4237 8.4237 17.8698 17.8698 19.7664 19.7664 20.7086 20.7086 k = 0.0756 0.5250 0.9783 ( 525 PWs) bands (ev): -6.6629 -6.6629 -4.7211 -4.7211 -2.7727 -2.7727 5.2144 5.2144 8.5063 8.5063 17.9118 17.9118 19.7929 19.7929 20.4627 20.4627 k = 0.0814 0.5140 0.9783 ( 525 PWs) bands (ev): -6.7241 -6.7241 -4.7370 -4.7370 -2.6602 -2.6602 5.1482 5.1482 8.5878 8.5878 17.9610 17.9610 19.8157 19.8157 20.2161 20.2161 k = 0.0872 0.5029 0.9783 ( 526 PWs) bands (ev): -6.7838 -6.7838 -4.7589 -4.7589 -2.5398 -2.5398 5.0818 5.0818 8.6676 8.6676 18.0174 18.0174 19.8311 19.8311 19.9735 19.9735 k = 0.0930 0.4918 0.9783 ( 526 PWs) bands (ev): -6.8421 -6.8421 -4.7854 -4.7854 -2.4131 -2.4131 5.0157 5.0157 8.7452 8.7452 18.0809 18.0809 19.7094 19.7094 19.8653 19.8653 k = 0.0988 0.4807 0.9783 ( 530 PWs) bands (ev): -6.8988 -6.8988 -4.8154 -4.8154 -2.2816 -2.2816 4.9501 4.9501 8.8202 8.8202 18.1515 18.1515 19.4664 19.4664 19.8758 19.8758 k = 0.1047 0.4696 0.9783 ( 528 PWs) bands (ev): -6.9538 -6.9538 -4.8476 -4.8476 -2.1464 -2.1464 4.8854 4.8854 8.8923 8.8923 18.2289 18.2289 19.2215 19.2215 19.8875 19.8875 k = 0.1105 0.4585 0.9783 ( 526 PWs) bands (ev): -7.0071 -7.0071 -4.8815 -4.8815 -2.0085 -2.0085 4.8218 4.8218 8.9613 8.9613 18.3131 18.3131 18.9777 18.9777 19.8976 19.8976 k = 0.1163 0.4474 0.9783 ( 526 PWs) bands (ev): -7.0588 -7.0588 -4.9164 -4.9164 -1.8688 -1.8688 4.7595 4.7595 9.0269 9.0269 18.4037 18.4037 18.7360 18.7360 19.9053 19.9053 k = 0.1221 0.4363 0.9783 ( 526 PWs) bands (ev): -7.1088 -7.1088 -4.9518 -4.9518 -1.7280 -1.7280 4.6986 4.6986 9.0891 9.0891 18.4967 18.4967 18.5007 18.5007 19.9109 19.9109 k = 0.1279 0.4253 0.9783 ( 528 PWs) bands (ev): -7.1570 -7.1570 -4.9873 -4.9873 -1.5868 -1.5868 4.6394 4.6394 9.1478 9.1478 18.2609 18.2609 18.6031 18.6031 19.9145 19.9145 k = 0.1337 0.4142 0.9783 ( 530 PWs) bands (ev): -7.2035 -7.2035 -5.0227 -5.0227 -1.4456 -1.4456 4.5819 4.5819 9.2029 9.2029 18.0286 18.0286 18.7111 18.7111 19.9163 19.9163 k = 0.1395 0.4031 0.9783 ( 528 PWs) bands (ev): -7.2481 -7.2481 -5.0576 -5.0576 -1.3050 -1.3050 4.5263 4.5263 9.2548 9.2548 17.8003 17.8003 18.8242 18.8242 19.9166 19.9166 k = 0.1453 0.3920 0.9783 ( 530 PWs) bands (ev): -7.2910 -7.2910 -5.0918 -5.0918 -1.1656 -1.1656 4.4726 4.4726 9.3030 9.3030 17.5762 17.5762 18.9416 18.9416 19.9154 19.9154 k = 0.1512 0.3809 0.9783 ( 530 PWs) bands (ev): -7.3320 -7.3320 -5.1252 -5.1252 -1.0278 -1.0278 4.4208 4.4208 9.3479 9.3479 17.3573 17.3573 19.0630 19.0630 19.9130 19.9130 k = 0.1570 0.3698 0.9783 ( 528 PWs) bands (ev): -7.3712 -7.3712 -5.1576 -5.1576 -0.8918 -0.8918 4.3712 4.3712 9.3897 9.3897 17.1438 17.1438 19.1877 19.1877 19.9094 19.9094 k = 0.1628 0.3587 0.9783 ( 527 PWs) bands (ev): -7.4086 -7.4086 -5.1888 -5.1888 -0.7584 -0.7584 4.3237 4.3237 9.4282 9.4282 16.9360 16.9360 19.3150 19.3150 19.9050 19.9050 k = 0.1686 0.3476 0.9783 ( 525 PWs) bands (ev): -7.4442 -7.4442 -5.2189 -5.2189 -0.6280 -0.6280 4.2784 4.2784 9.4639 9.4639 16.7345 16.7345 19.4442 19.4442 19.8998 19.8998 k = 0.1744 0.3366 0.9783 ( 527 PWs) bands (ev): -7.4779 -7.4779 -5.2478 -5.2478 -0.5009 -0.5009 4.2353 4.2353 9.4965 9.4965 16.5396 16.5396 19.5746 19.5746 19.8939 19.8939 k = 0.1802 0.3255 0.9783 ( 527 PWs) bands (ev): -7.5097 -7.5097 -5.2752 -5.2752 -0.3776 -0.3776 4.1944 4.1944 9.5265 9.5265 16.3520 16.3520 19.7053 19.7053 19.8876 19.8876 k = 0.1860 0.3144 0.9783 ( 527 PWs) bands (ev): -7.5397 -7.5397 -5.3013 -5.3013 -0.2586 -0.2586 4.1559 4.1559 9.5540 9.5540 16.1719 16.1719 19.8357 19.8357 19.8810 19.8810 k = 0.1919 0.3033 0.9783 ( 527 PWs) bands (ev): -7.5678 -7.5678 -5.3260 -5.3260 -0.1443 -0.1443 4.1196 4.1196 9.5791 9.5791 15.9999 15.9999 19.8742 19.8742 19.9647 19.9647 k = 0.1977 0.2922 0.9783 ( 527 PWs) bands (ev): -7.5940 -7.5940 -5.3491 -5.3491 -0.0351 -0.0351 4.0858 4.0858 9.6020 9.6020 15.8365 15.8365 19.8673 19.8673 20.0916 20.0916 k = 0.2035 0.2811 0.9783 ( 527 PWs) bands (ev): -7.6183 -7.6183 -5.3707 -5.3707 0.0684 0.0684 4.0543 4.0543 9.6227 9.6227 15.6821 15.6821 19.8605 19.8605 20.2154 20.2154 k = 0.2093 0.2700 0.9783 ( 527 PWs) bands (ev): -7.6408 -7.6408 -5.3907 -5.3907 0.1659 0.1659 4.0252 4.0252 9.6416 9.6416 15.5372 15.5372 19.8538 19.8538 20.3354 20.3354 k = 0.2151 0.2590 0.9783 ( 527 PWs) bands (ev): -7.6614 -7.6614 -5.4091 -5.4091 0.2569 0.2569 3.9985 3.9985 9.6587 9.6587 15.4022 15.4022 19.8474 19.8474 20.4505 20.4505 k = 0.2209 0.2479 0.9783 ( 527 PWs) bands (ev): -7.6801 -7.6801 -5.4259 -5.4259 0.3409 0.3409 3.9742 3.9742 9.6741 9.6741 15.2776 15.2776 19.8413 19.8413 20.5601 20.5601 k = 0.2267 0.2368 0.9783 ( 529 PWs) bands (ev): -7.6969 -7.6969 -5.4410 -5.4410 0.4174 0.4174 3.9524 3.9524 9.6880 9.6880 15.1639 15.1639 19.8356 19.8356 20.6634 20.6634 k = 0.2326 0.2257 0.9783 ( 527 PWs) bands (ev): -7.7118 -7.7118 -5.4545 -5.4545 0.4862 0.4862 3.9331 3.9331 9.7005 9.7005 15.0614 15.0614 19.8304 19.8304 20.7597 20.7597 k = 0.2384 0.2146 0.9783 ( 525 PWs) bands (ev): -7.7247 -7.7247 -5.4663 -5.4663 0.5469 0.5469 3.9163 3.9163 9.7117 9.7117 14.9706 14.9706 19.8258 19.8258 20.8483 20.8483 k = 0.2442 0.2035 0.9783 ( 525 PWs) bands (ev): -7.7359 -7.7359 -5.4764 -5.4764 0.5990 0.5990 3.9018 3.9018 9.7217 9.7217 14.8918 14.8918 19.8217 19.8217 20.9287 20.9287 k = 0.2500 0.1924 0.9783 ( 523 PWs) bands (ev): -7.7451 -7.7451 -5.4848 -5.4848 0.6423 0.6423 3.8899 3.8899 9.7306 9.7306 14.8253 14.8253 19.8183 19.8183 21.0005 21.0005 k = 0.2558 0.1813 0.9783 ( 523 PWs) bands (ev): -7.7524 -7.7524 -5.4915 -5.4915 0.6764 0.6764 3.8805 3.8805 9.7384 9.7384 14.7714 14.7714 19.8155 19.8155 21.0634 21.0634 k = 0.2616 0.1703 0.9783 ( 521 PWs) bands (ev): -7.7578 -7.7578 -5.4965 -5.4965 0.7014 0.7014 3.8735 3.8735 9.7453 9.7453 14.7303 14.7303 19.8135 19.8135 21.1171 21.1171 k = 0.2674 0.1592 0.9783 ( 521 PWs) bands (ev): -7.7613 -7.7613 -5.4997 -5.4997 0.7168 0.7168 3.8691 3.8691 9.7513 9.7513 14.7021 14.7021 19.8121 19.8121 21.1616 21.1616 k = 0.2733 0.1481 0.9783 ( 521 PWs) bands (ev): -7.7630 -7.7630 -5.5013 -5.5013 0.7224 0.7224 3.8672 3.8672 9.7564 9.7564 14.6869 14.6869 19.8116 19.8116 21.1966 21.1966 k = 0.2791 0.1370 0.9783 ( 521 PWs) bands (ev): -7.7627 -7.7627 -5.5011 -5.5011 0.7184 0.7184 3.8677 3.8677 9.7605 9.7605 14.6848 14.6848 19.8118 19.8118 21.2222 21.2222 k = 0.2849 0.1259 0.9783 ( 519 PWs) bands (ev): -7.7604 -7.7604 -5.4992 -5.4992 0.7047 0.7047 3.8710 3.8710 9.7639 9.7639 14.6957 14.6957 19.8128 19.8128 21.2387 21.2387 k = 0.2907 0.1148 0.9783 ( 519 PWs) bands (ev): -7.7563 -7.7563 -5.4956 -5.4956 0.6815 0.6815 3.8766 3.8766 9.7665 9.7665 14.7195 14.7195 19.8145 19.8145 21.2461 21.2461 k = 0.2965 0.1037 0.9783 ( 521 PWs) bands (ev): -7.7503 -7.7503 -5.4903 -5.4903 0.6487 0.6487 3.8847 3.8847 9.7681 9.7681 14.7559 14.7559 19.8169 19.8169 21.2445 21.2445 k = 0.3023 0.0926 0.9783 ( 521 PWs) bands (ev): -7.7424 -7.7424 -5.4832 -5.4832 0.6068 0.6068 3.8953 3.8953 9.7691 9.7691 14.8049 14.8049 19.8200 19.8200 21.2344 21.2344 k = 0.3081 0.0816 0.9783 ( 521 PWs) bands (ev): -7.7327 -7.7327 -5.4745 -5.4745 0.5559 0.5559 3.9084 3.9084 9.7691 9.7691 14.8661 14.8661 19.8239 19.8239 21.2161 21.2161 k = 0.3140 0.0705 0.9783 ( 521 PWs) bands (ev): -7.7210 -7.7210 -5.4640 -5.4640 0.4964 0.4964 3.9240 3.9240 9.7684 9.7684 14.9392 14.9392 19.8283 19.8283 21.1898 21.1898 k = 0.3198 0.0594 0.9783 ( 521 PWs) bands (ev): -7.7074 -7.7074 -5.4519 -5.4519 0.4285 0.4285 3.9421 3.9421 9.7667 9.7667 15.0237 15.0237 19.8334 19.8334 21.1559 21.1559 k = 0.3256 0.0483 0.9783 ( 525 PWs) bands (ev): -7.6919 -7.6919 -5.4382 -5.4382 0.3525 0.3525 3.9626 3.9626 9.7640 9.7640 15.1192 15.1192 19.8389 19.8389 21.1148 21.1148 k = 0.3314 0.0372 0.9783 ( 525 PWs) bands (ev): -7.6746 -7.6746 -5.4228 -5.4228 0.2690 0.2690 3.9857 3.9857 9.7604 9.7604 15.2252 15.2252 19.8450 19.8450 21.0670 21.0670 k = 0.3372 0.0261 0.9783 ( 525 PWs) bands (ev): -7.6553 -7.6553 -5.4057 -5.4057 0.1783 0.1783 4.0112 4.0112 9.7557 9.7557 15.3413 15.3413 19.8515 19.8515 21.0129 21.0129 k = 0.3430 0.0150 0.9783 ( 525 PWs) bands (ev): -7.6342 -7.6342 -5.3871 -5.3871 0.0810 0.0810 4.0392 4.0392 9.7499 9.7499 15.4669 15.4669 19.8583 19.8583 20.9531 20.9531 k = 0.3488 0.0039 0.9783 ( 523 PWs) bands (ev): -7.6112 -7.6112 -5.3669 -5.3669 -0.0226 -0.0226 4.0696 4.0696 9.7428 9.7428 15.6015 15.6015 19.8654 19.8654 20.8880 20.8880 k = 0.3547-0.0071 0.9783 ( 523 PWs) bands (ev): -7.5863 -7.5863 -5.3451 -5.3451 -0.1321 -0.1321 4.1025 4.1025 9.7344 9.7344 15.7443 15.7443 19.8727 19.8727 20.8183 20.8183 k = 0.3605-0.0182 0.9783 ( 523 PWs) bands (ev): -7.5595 -7.5595 -5.3219 -5.3219 -0.2469 -0.2469 4.1378 4.1378 9.7247 9.7247 15.8950 15.8950 19.8800 19.8800 20.7443 20.7443 k = 0.3663-0.0293 0.9783 ( 523 PWs) bands (ev): -7.5309 -7.5309 -5.2972 -5.2972 -0.3666 -0.3666 4.1755 4.1755 9.7134 9.7134 16.0528 16.0528 19.8872 19.8872 20.6669 20.6669 k = 0.3721-0.0404 0.9783 ( 523 PWs) bands (ev): -7.5004 -7.5004 -5.2711 -5.2711 -0.4908 -0.4908 4.2156 4.2156 9.7004 9.7004 16.2171 16.2171 19.8942 19.8942 20.5864 20.5864 k = 0.3779-0.0515 0.9783 ( 521 PWs) bands (ev): -7.4680 -7.4680 -5.2436 -5.2436 -0.6189 -0.6189 4.2580 4.2580 9.6858 9.6858 16.3874 16.3874 19.9009 19.9009 20.5037 20.5037 k = 0.3837-0.0626 0.9783 ( 519 PWs) bands (ev): -7.4338 -7.4338 -5.2149 -5.2149 -0.7505 -0.7505 4.3028 4.3028 9.6694 9.6694 16.5630 16.5630 19.9072 19.9072 20.4191 20.4191 k = 0.3895-0.0737 0.9783 ( 519 PWs) bands (ev): -7.3978 -7.3978 -5.1850 -5.1850 -0.8852 -0.8852 4.3499 4.3499 9.6509 9.6509 16.7429 16.7429 19.9129 19.9129 20.3335 20.3335 k = 0.3953-0.0848 0.9783 ( 521 PWs) bands (ev): -7.3599 -7.3599 -5.1541 -5.1541 -1.0226 -1.0226 4.3993 4.3993 9.6304 9.6304 16.9267 16.9267 19.9178 19.9178 20.2474 20.2474 k = 0.4012-0.0958 0.9783 ( 519 PWs) bands (ev): -7.3202 -7.3202 -5.1221 -5.1221 -1.1623 -1.1623 4.4510 4.4510 9.6077 9.6077 17.1136 17.1136 19.9219 19.9219 20.1613 20.1613 k = 0.4070-0.1069 0.9783 ( 517 PWs) bands (ev): -7.2787 -7.2787 -5.0893 -5.0893 -1.3034 -1.3034 4.5048 4.5048 9.5827 9.5827 17.3031 17.3031 19.9249 19.9249 20.0760 20.0760 k = 0.4128-0.1180 0.9783 ( 517 PWs) bands (ev): -7.2354 -7.2354 -5.0559 -5.0559 -1.4458 -1.4458 4.5609 4.5609 9.5552 9.5552 17.4937 17.4937 19.9266 19.9266 19.9920 19.9920 k = 0.4186-0.1291 0.9783 ( 519 PWs) bands (ev): -7.1903 -7.1903 -5.0220 -5.0220 -1.5890 -1.5890 4.6190 4.6190 9.5251 9.5251 17.6848 17.6848 19.9096 19.9096 19.9270 19.9270 k = 0.4244-0.1402 0.9783 ( 519 PWs) bands (ev): -7.1434 -7.1434 -4.9880 -4.9880 -1.7324 -1.7324 4.6792 4.6792 9.4926 9.4926 17.8755 17.8755 19.8298 19.8298 19.9259 19.9259 k = 0.4302-0.1513 0.9783 ( 517 PWs) bands (ev): -7.0948 -7.0948 -4.9540 -4.9540 -1.8754 -1.8754 4.7415 4.7415 9.4574 9.4574 18.0647 18.0647 19.7528 19.7528 19.9231 19.9231 k = 0.4360-0.1624 0.9783 ( 517 PWs) bands (ev): -7.0445 -7.0445 -4.9207 -4.9207 -2.0173 -2.0173 4.8056 4.8056 9.4195 9.4195 18.2513 18.2513 19.6792 19.6792 19.9184 19.9184 k = 0.4419-0.1735 0.9783 ( 517 PWs) bands (ev): -6.9925 -6.9925 -4.8884 -4.8884 -2.1574 -2.1574 4.8717 4.8717 9.3789 9.3789 18.4339 18.4339 19.6094 19.6094 19.9117 19.9117 k = 0.4477-0.1845 0.9783 ( 523 PWs) bands (ev): -6.9388 -6.9388 -4.8577 -4.8577 -2.2949 -2.2949 4.9394 4.9394 9.3354 9.3354 18.6111 18.6111 19.5438 19.5438 19.9027 19.9027 k = 0.4535-0.1956 0.9783 ( 519 PWs) bands (ev): -6.8836 -6.8836 -4.8294 -4.8294 -2.4287 -2.4287 5.0090 5.0090 9.2892 9.2892 18.7818 18.7818 19.4829 19.4829 19.8919 19.8919 k = 0.4593-0.2067 0.9783 ( 517 PWs) bands (ev): -6.8267 -6.8267 -4.8045 -4.8045 -2.5577 -2.5577 5.0799 5.0799 9.2404 9.2404 18.9433 18.9433 19.4270 19.4270 19.8790 19.8790 k = 0.4651-0.2178 0.9783 ( 517 PWs) bands (ev): -6.7684 -6.7684 -4.7842 -4.7842 -2.6804 -2.6804 5.1522 5.1522 9.1889 9.1889 19.0939 19.0939 19.3762 19.3762 19.8643 19.8643 k = 0.4709-0.2289 0.9783 ( 517 PWs) bands (ev): -6.7087 -6.7087 -4.7700 -4.7700 -2.7953 -2.7953 5.2258 5.2258 9.1350 9.1350 19.2314 19.2314 19.3311 19.3311 19.8481 19.8481 k = 0.4767-0.2400 0.9783 ( 515 PWs) bands (ev): -6.6477 -6.6477 -4.7635 -4.7635 -2.9002 -2.9002 5.3003 5.3003 9.0788 9.0788 19.2917 19.2917 19.3529 19.3529 19.8313 19.8313 k = 0.4826-0.2511 0.9783 ( 518 PWs) bands (ev): -6.5856 -6.5856 -4.7666 -4.7666 -2.9934 -2.9934 5.3755 5.3755 9.0205 9.0205 19.2583 19.2583 19.4543 19.4543 19.8160 19.8160 k = 0.4884-0.2622 0.9783 ( 518 PWs) bands (ev): -6.5226 -6.5226 -4.7809 -4.7809 -3.0725 -3.0725 5.4512 5.4512 8.9606 8.9606 19.2312 19.2312 19.5301 19.5301 19.8059 19.8059 k = 0.4942-0.2732 0.9783 ( 518 PWs) bands (ev): -6.4589 -6.4589 -4.8078 -4.8078 -3.1358 -3.1358 5.5271 5.5271 8.8993 8.8993 19.2104 19.2104 19.5736 19.5736 19.8062 19.8062 k = 0.5000-0.2843 0.9783 ( 520 PWs) bands (ev): -6.3950 -6.3950 -4.8481 -4.8481 -3.1822 -3.1822 5.6026 5.6026 8.8371 8.8371 19.1960 19.1960 19.5832 19.5832 19.8170 19.8170 k = 0.5000-0.2843 0.9783 ( 520 PWs) bands (ev): -6.3950 -6.3950 -4.8481 -4.8481 -3.1822 -3.1822 5.6026 5.6026 8.8371 8.8371 19.1960 19.1960 19.5832 19.5832 19.8170 19.8170 k = 0.5000-0.2914 0.9681 ( 518 PWs) bands (ev): -6.2690 -6.2690 -4.9404 -4.9404 -3.2546 -3.2546 5.7518 5.7518 8.7140 8.7140 19.1751 19.1751 19.5725 19.5725 19.8407 19.8407 k = 0.5000-0.2984 0.9578 ( 520 PWs) bands (ev): -6.1459 -6.1459 -5.0311 -5.0311 -3.3217 -3.3217 5.9002 5.9002 8.5929 8.5929 19.1568 19.1568 19.5595 19.5595 19.8585 19.8585 k = 0.5000-0.3054 0.9475 ( 520 PWs) bands (ev): -6.0263 -6.0263 -5.1200 -5.1200 -3.3824 -3.3824 6.0477 6.0477 8.4740 8.4740 19.1417 19.1417 19.5444 19.5444 19.8706 19.8706 k = 0.5000-0.3124 0.9373 ( 520 PWs) bands (ev): -5.9113 -5.9113 -5.2072 -5.2072 -3.4358 -3.4358 6.1941 6.1941 8.3571 8.3571 19.1300 19.1300 19.5272 19.5272 19.8770 19.8770 k = 0.5000-0.3195 0.9270 ( 516 PWs) bands (ev): -5.8021 -5.8021 -5.2927 -5.2927 -3.4806 -3.4806 6.3394 6.3394 8.2426 8.2426 19.1221 19.1221 19.5080 19.5080 19.8780 19.8780 k = 0.5000-0.3265 0.9167 ( 516 PWs) bands (ev): -5.7002 -5.7002 -5.3765 -5.3765 -3.5154 -3.5154 6.4831 6.4831 8.1299 8.1299 19.1184 19.1184 19.4868 19.4868 19.8737 19.8737 k = 0.5000-0.3335 0.9065 ( 512 PWs) bands (ev): -5.6073 -5.6073 -5.4585 -5.4585 -3.5386 -3.5386 6.6252 6.6252 8.0195 8.0195 19.1191 19.1191 19.4639 19.4639 19.8645 19.8645 k = 0.5000-0.3405 0.8962 ( 520 PWs) bands (ev): -5.5390 -5.5390 -5.5252 -5.5252 -3.5487 -3.5487 6.7654 6.7654 7.9112 7.9112 19.1246 19.1246 19.4391 19.4391 19.8505 19.8505 k = 0.5000-0.3476 0.8859 ( 516 PWs) bands (ev): -5.6174 -5.6174 -5.4554 -5.4554 -3.5438 -3.5438 6.9037 6.9037 7.8052 7.8052 19.1352 19.1352 19.4127 19.4127 19.8323 19.8323 k = 0.5000-0.3546 0.8756 ( 516 PWs) bands (ev): -5.6942 -5.6942 -5.3992 -5.3992 -3.5227 -3.5227 7.0395 7.0395 7.7012 7.7012 19.1513 19.1513 19.3852 19.3852 19.8102 19.8102 k = 0.5000-0.3616 0.8654 ( 516 PWs) bands (ev): -5.7693 -5.7693 -5.3574 -5.3574 -3.4850 -3.4850 7.1730 7.1730 7.5996 7.5996 19.1731 19.1731 19.3559 19.3559 19.7842 19.7842 k = 0.5000-0.3686 0.8551 ( 516 PWs) bands (ev): -5.8425 -5.8425 -5.3297 -5.3297 -3.4308 -3.4308 7.3038 7.3038 7.5002 7.5002 19.2009 19.2009 19.3255 19.3255 19.7549 19.7549 k = 0.5000-0.3757 0.8448 ( 516 PWs) bands (ev): -5.9140 -5.9140 -5.3154 -5.3154 -3.3609 -3.3609 7.4032 7.4032 7.4318 7.4318 19.2349 19.2349 19.2940 19.2940 19.7226 19.7226 k = 0.5000-0.3827 0.8346 ( 516 PWs) bands (ev): -5.9837 -5.9837 -5.3131 -5.3131 -3.2769 -3.2769 7.3084 7.3084 7.5567 7.5567 19.2615 19.2615 19.2756 19.2756 19.6874 19.6874 k = 0.5000-0.3897 0.8243 ( 516 PWs) bands (ev): -6.0516 -6.0516 -5.3211 -5.3211 -3.1805 -3.1805 7.2159 7.2159 7.6785 7.6785 19.2283 19.2283 19.3230 19.3230 19.6497 19.6497 k = 0.5000-0.3967 0.8140 ( 514 PWs) bands (ev): -6.1178 -6.1178 -5.3375 -5.3375 -3.0734 -3.0734 7.1258 7.1258 7.7969 7.7969 19.1944 19.1944 19.3774 19.3774 19.6096 19.6096 k = 0.5000-0.4037 0.8038 ( 514 PWs) bands (ev): -6.1821 -6.1821 -5.3609 -5.3609 -2.9578 -2.9578 7.0379 7.0379 7.9118 7.9118 19.1600 19.1600 19.4390 19.4390 19.5671 19.5671 k = 0.5000-0.4108 0.7935 ( 514 PWs) bands (ev): -6.2447 -6.2447 -5.3895 -5.3895 -2.8351 -2.8351 6.9524 6.9524 8.0231 8.0231 19.1252 19.1252 19.5079 19.5079 19.5218 19.5218 k = 0.5000-0.4178 0.7832 ( 514 PWs) bands (ev): -6.3055 -6.3055 -5.4222 -5.4222 -2.7068 -2.7068 6.8693 6.8693 8.1306 8.1306 19.0901 19.0901 19.4729 19.4729 19.5845 19.5845 k = 0.5000-0.4248 0.7730 ( 512 PWs) bands (ev): -6.3645 -6.3645 -5.4578 -5.4578 -2.5738 -2.5738 6.7886 6.7886 8.2341 8.2341 19.0550 19.0550 19.4180 19.4180 19.6687 19.6687 k = 0.5000-0.4318 0.7627 ( 512 PWs) bands (ev): -6.4217 -6.4217 -5.4956 -5.4956 -2.4375 -2.4375 6.7102 6.7102 8.3337 8.3337 19.0198 19.0198 19.3501 19.3501 19.7607 19.7607 k = 0.5000-0.4389 0.7524 ( 516 PWs) bands (ev): -6.4772 -6.4772 -5.5349 -5.5349 -2.2985 -2.2985 6.6340 6.6340 8.4292 8.4292 18.9847 18.9847 19.2512 19.2512 19.5749 19.5749 k = 0.5000-0.4459 0.7421 ( 516 PWs) bands (ev): -6.5309 -6.5309 -5.5750 -5.5750 -2.1576 -2.1576 6.5604 6.5604 8.5206 8.5206 18.9498 18.9498 19.0968 19.0968 19.4433 19.4433 k = 0.5000-0.4529 0.7319 ( 516 PWs) bands (ev): -6.5827 -6.5827 -5.6156 -5.6156 -2.0154 -2.0154 6.4893 6.4893 8.6078 8.6078 18.8965 18.8965 18.9155 18.9155 19.3600 19.3600 k = 0.5000-0.4599 0.7216 ( 516 PWs) bands (ev): -6.6327 -6.6327 -5.6561 -5.6561 -1.8724 -1.8724 6.4205 6.4205 8.6909 8.6909 18.6777 18.6777 18.8812 18.8812 19.2988 19.2988 k = 0.5000-0.4670 0.7113 ( 516 PWs) bands (ev): -6.6809 -6.6809 -5.6964 -5.6964 -1.7293 -1.7293 6.3542 6.3542 8.7698 8.7698 18.4533 18.4533 18.8476 18.8476 19.2468 19.2468 k = 0.5000-0.4740 0.7011 ( 520 PWs) bands (ev): -6.7273 -6.7273 -5.7362 -5.7362 -1.5865 -1.5865 6.2903 6.2903 8.8446 8.8446 18.2282 18.2282 18.8146 18.8146 19.1995 19.1995 k = 0.5000-0.4810 0.6908 ( 516 PWs) bands (ev): -6.7719 -6.7719 -5.7753 -5.7753 -1.4440 -1.4440 6.2288 6.2288 8.9154 8.9154 18.0052 18.0052 18.7823 18.7823 19.1551 19.1551 k = 0.5000-0.4880 0.6805 ( 520 PWs) bands (ev): -6.8148 -6.8148 -5.8135 -5.8135 -1.3030 -1.3030 6.1697 6.1697 8.9819 8.9819 17.7852 17.7852 18.7508 18.7508 19.1129 19.1129 k = 0.5000-0.4951 0.6703 ( 520 PWs) bands (ev): -6.8557 -6.8557 -5.8507 -5.8507 -1.1635 -1.1635 6.1132 6.1132 9.0445 9.0445 17.5693 17.5693 18.7202 18.7202 19.0725 19.0725 k = 0.5000-0.5021 0.6600 ( 520 PWs) bands (ev): -6.8949 -6.8949 -5.8867 -5.8867 -1.0260 -1.0260 6.0591 6.0591 9.1032 9.1032 17.3582 17.3582 18.6904 18.6904 19.0337 19.0337 k = 0.5000-0.5091 0.6497 ( 520 PWs) bands (ev): -6.9323 -6.9323 -5.9215 -5.9215 -0.8908 -0.8908 6.0075 6.0075 9.1581 9.1581 17.1523 17.1523 18.6617 18.6617 18.9965 18.9965 k = 0.5000-0.5161 0.6394 ( 528 PWs) bands (ev): -6.9678 -6.9678 -5.9550 -5.9550 -0.7586 -0.7586 5.9583 5.9583 9.2092 9.2092 16.9514 16.9514 18.6341 18.6341 18.9608 18.9608 k = 0.5000-0.5232 0.6292 ( 528 PWs) bands (ev): -7.0015 -7.0015 -5.9870 -5.9870 -0.6293 -0.6293 5.9117 5.9117 9.2568 9.2568 16.7576 16.7576 18.6075 18.6075 18.9268 18.9268 k = 0.5000-0.5302 0.6189 ( 528 PWs) bands (ev): -7.0335 -7.0335 -6.0176 -6.0176 -0.5035 -0.5035 5.8675 5.8675 9.3009 9.3009 16.5705 16.5705 18.5821 18.5821 18.8943 18.8943 k = 0.5000-0.5372 0.6086 ( 524 PWs) bands (ev): -7.0635 -7.0635 -6.0465 -6.0465 -0.3818 -0.3818 5.8262 5.8262 9.3419 9.3419 16.3907 16.3907 18.5581 18.5581 18.8636 18.8636 k = 0.5000-0.5442 0.5984 ( 524 PWs) bands (ev): -7.0917 -7.0917 -6.0740 -6.0740 -0.2645 -0.2645 5.7871 5.7871 9.3795 9.3795 16.2186 16.2186 18.5351 18.5351 18.8345 18.8345 k = 0.5000-0.5513 0.5881 ( 524 PWs) bands (ev): -7.1182 -7.1182 -6.0998 -6.0998 -0.1519 -0.1519 5.7505 5.7505 9.4139 9.4139 16.0547 16.0547 18.5135 18.5135 18.8070 18.8070 k = 0.5000-0.5583 0.5778 ( 524 PWs) bands (ev): -7.1428 -7.1428 -6.1240 -6.1240 -0.0447 -0.0447 5.7163 5.7163 9.4454 9.4454 15.8994 15.8994 18.4933 18.4933 18.7813 18.7813 k = 0.5000-0.5653 0.5676 ( 524 PWs) bands (ev): -7.1656 -7.1656 -6.1465 -6.1465 0.0569 0.0569 5.6847 5.6847 9.4739 9.4739 15.7532 15.7532 18.4743 18.4743 18.7574 18.7574 k = 0.5000-0.5723 0.5573 ( 524 PWs) bands (ev): -7.1866 -7.1866 -6.1672 -6.1672 0.1523 0.1523 5.6556 5.6556 9.4998 9.4998 15.6166 15.6166 18.4568 18.4568 18.7352 18.7352 k = 0.5000-0.5794 0.5470 ( 524 PWs) bands (ev): -7.2057 -7.2057 -6.1863 -6.1863 0.2412 0.2412 5.6290 5.6290 9.5230 9.5230 15.4901 15.4901 18.4408 18.4408 18.7149 18.7149 k = 0.5000-0.5864 0.5368 ( 524 PWs) bands (ev): -7.2231 -7.2231 -6.2035 -6.2035 0.3231 0.3231 5.6050 5.6050 9.5436 9.5436 15.3740 15.3740 18.4261 18.4261 18.6965 18.6965 k = 0.5000-0.5934 0.5265 ( 524 PWs) bands (ev): -7.2386 -7.2386 -6.2190 -6.2190 0.3977 0.3977 5.5834 5.5834 9.5618 9.5618 15.2689 15.2689 18.4130 18.4130 18.6799 18.6799 k = 0.5000-0.6004 0.5162 ( 524 PWs) bands (ev): -7.2523 -7.2523 -6.2328 -6.2328 0.4644 0.4644 5.5644 5.5644 9.5777 9.5777 15.1750 15.1750 18.4014 18.4014 18.6653 18.6653 k = 0.5000-0.6075 0.5059 ( 520 PWs) bands (ev): -7.2641 -7.2641 -6.2446 -6.2446 0.5231 0.5231 5.5480 5.5480 9.5913 9.5913 15.0929 15.0929 18.3913 18.3913 18.6526 18.6526 k = 0.5000-0.6145 0.4957 ( 520 PWs) bands (ev): -7.2742 -7.2742 -6.2547 -6.2547 0.5734 0.5734 5.5340 5.5340 9.6027 9.6027 15.0227 15.0227 18.3827 18.3827 18.6418 18.6418 k = 0.5000-0.6215 0.4854 ( 520 PWs) bands (ev): -7.2824 -7.2824 -6.2630 -6.2630 0.6149 0.6149 5.5226 5.5226 9.6119 9.6119 14.9649 14.9649 18.3757 18.3757 18.6329 18.6329 k = 0.5000-0.6285 0.4751 ( 520 PWs) bands (ev): -7.2887 -7.2887 -6.2693 -6.2693 0.6473 0.6473 5.5138 5.5138 9.6190 9.6190 14.9197 14.9197 18.3702 18.3702 18.6260 18.6260 k = 0.5000-0.6356 0.4649 ( 520 PWs) bands (ev): -7.2933 -7.2933 -6.2739 -6.2739 0.6707 0.6707 5.5074 5.5074 9.6241 9.6241 14.8873 14.8873 18.3662 18.3662 18.6211 18.6211 k = 0.5000-0.6426 0.4546 ( 520 PWs) bands (ev): -7.2960 -7.2960 -6.2767 -6.2767 0.6848 0.6848 5.5036 5.5036 9.6271 9.6271 14.8677 14.8677 18.3639 18.3639 18.6181 18.6181 k = 0.5000-0.6496 0.4443 ( 520 PWs) bands (ev): -7.2969 -7.2969 -6.2776 -6.2776 0.6895 0.6895 5.5024 5.5024 9.6281 9.6281 14.8612 14.8612 18.3631 18.3631 18.6171 18.6171 k = 1.0000-0.3874 0.2650 ( 520 PWs) bands (ev): -7.0695 -7.0695 -6.1022 -6.1022 0.6344 0.6344 4.0491 4.0491 8.0714 8.0714 14.4562 14.4562 21.0040 21.0040 24.6382 24.6382 k = 1.0000-0.3805 0.2751 ( 516 PWs) bands (ev): -7.0686 -7.0686 -6.1013 -6.1013 0.6300 0.6300 4.0504 4.0504 8.0717 8.0717 14.4626 14.4626 20.9991 20.9991 24.6393 24.6393 k = 1.0000-0.3736 0.2853 ( 518 PWs) bands (ev): -7.0660 -7.0660 -6.0987 -6.0987 0.6158 0.6158 4.0542 4.0542 8.0720 8.0720 14.4811 14.4811 20.9838 20.9838 24.6428 24.6428 k = 1.0000-0.3666 0.2954 ( 516 PWs) bands (ev): -7.0617 -7.0617 -6.0943 -6.0943 0.5923 0.5923 4.0606 4.0606 8.0728 8.0728 14.5120 14.5120 20.9587 20.9587 24.6486 24.6486 k = 1.0000-0.3597 0.3055 ( 516 PWs) bands (ev): -7.0556 -7.0556 -6.0882 -6.0882 0.5597 0.5597 4.0696 4.0696 8.0739 8.0739 14.5549 14.5549 20.9239 20.9239 24.6568 24.6568 k = 1.0000-0.3528 0.3157 ( 516 PWs) bands (ev): -7.0478 -7.0478 -6.0804 -6.0804 0.5181 0.5181 4.0811 4.0811 8.0753 8.0753 14.6097 14.6097 20.8797 20.8797 24.6672 24.6672 k = 1.0000-0.3458 0.3258 ( 516 PWs) bands (ev): -7.0382 -7.0382 -6.0708 -6.0708 0.4677 0.4677 4.0952 4.0952 8.0769 8.0769 14.6762 14.6762 20.8264 20.8264 24.6800 24.6800 k = 1.0000-0.3389 0.3359 ( 516 PWs) bands (ev): -7.0269 -7.0269 -6.0596 -6.0596 0.4090 0.4090 4.1119 4.1119 8.0788 8.0788 14.7539 14.7539 20.7645 20.7645 24.6951 24.6951 k = 1.0000-0.3320 0.3461 ( 516 PWs) bands (ev): -7.0139 -7.0139 -6.0466 -6.0466 0.3421 0.3421 4.1311 4.1311 8.0807 8.0807 14.8425 14.8425 20.6944 20.6944 24.7125 24.7125 k = 1.0000-0.3250 0.3562 ( 516 PWs) bands (ev): -6.9991 -6.9991 -6.0319 -6.0319 0.2675 0.2675 4.1529 4.1529 8.0828 8.0828 14.9415 14.9415 20.6167 20.6167 24.7322 24.7322 k = 1.0000-0.3181 0.3663 ( 520 PWs) bands (ev): -6.9826 -6.9826 -6.0156 -6.0156 0.1854 0.1854 4.1772 4.1772 8.0849 8.0849 15.0506 15.0506 20.5319 20.5319 24.7542 24.7542 k = 1.0000-0.3112 0.3765 ( 520 PWs) bands (ev): -6.9644 -6.9644 -5.9976 -5.9976 0.0964 0.0964 4.2041 4.2041 8.0869 8.0869 15.1693 15.1693 20.4407 20.4407 24.7785 24.7785 k = 1.0000-0.3042 0.3866 ( 520 PWs) bands (ev): -6.9444 -6.9444 -5.9780 -5.9780 0.0009 0.0009 4.2335 4.2335 8.0889 8.0889 15.2970 15.2970 20.3436 20.3436 24.8051 24.8051 k = 1.0000-0.2973 0.3967 ( 524 PWs) bands (ev): -6.9228 -6.9228 -5.9569 -5.9569 -0.1007 -0.1007 4.2654 4.2654 8.0905 8.0905 15.4332 15.4332 20.2413 20.2413 24.8340 24.8340 k = 1.0000-0.2904 0.4069 ( 524 PWs) bands (ev): -6.8993 -6.8993 -5.9341 -5.9341 -0.2080 -0.2080 4.2999 4.2999 8.0920 8.0920 15.5774 15.5774 20.1345 20.1345 24.8651 24.8651 k = 1.0000-0.2834 0.4170 ( 524 PWs) bands (ev): -6.8741 -6.8741 -5.9097 -5.9097 -0.3206 -0.3206 4.3370 4.3370 8.0930 8.0930 15.7290 15.7290 20.0238 20.0238 24.8986 24.8986 k = 1.0000-0.2765 0.4271 ( 524 PWs) bands (ev): -6.8472 -6.8472 -5.8839 -5.8839 -0.4379 -0.4379 4.3767 4.3767 8.0936 8.0936 15.8875 15.8875 19.9097 19.9097 24.9342 24.9342 k = 1.0000-0.2696 0.4373 ( 524 PWs) bands (ev): -6.8186 -6.8186 -5.8566 -5.8566 -0.5596 -0.5596 4.4188 4.4188 8.0935 8.0935 16.0521 16.0521 19.7931 19.7931 24.9208 24.9208 k = 1.0000-0.2626 0.4474 ( 524 PWs) bands (ev): -6.7882 -6.7882 -5.8279 -5.8279 -0.6853 -0.6853 4.4635 4.4635 8.0926 8.0926 16.2225 16.2225 19.6743 19.6743 24.8013 24.8013 k = 1.0000-0.2557 0.4575 ( 524 PWs) bands (ev): -6.7561 -6.7561 -5.7979 -5.7979 -0.8145 -0.8145 4.5107 4.5107 8.0909 8.0909 16.3978 16.3978 19.5543 19.5543 24.6831 24.6831 k = 1.0000-0.2488 0.4677 ( 524 PWs) bands (ev): -6.7223 -6.7223 -5.7666 -5.7666 -0.9468 -0.9468 4.5605 4.5605 8.0881 8.0881 16.5774 16.5774 19.4334 19.4334 24.5660 24.5660 k = 1.0000-0.2419 0.4778 ( 524 PWs) bands (ev): -6.6867 -6.6867 -5.7341 -5.7341 -1.0818 -1.0818 4.6128 4.6128 8.0842 8.0842 16.7607 16.7607 19.3123 19.3123 24.4498 24.4498 k = 1.0000-0.2349 0.4879 ( 524 PWs) bands (ev): -6.6494 -6.6494 -5.7005 -5.7005 -1.2191 -1.2191 4.6675 4.6675 8.0789 8.0789 16.9470 16.9470 19.1916 19.1916 24.3348 24.3348 k = 1.0000-0.2280 0.4981 ( 524 PWs) bands (ev): -6.6104 -6.6104 -5.6660 -5.6660 -1.3582 -1.3582 4.7248 4.7248 8.0722 8.0722 17.1354 17.1354 19.0718 19.0718 24.2208 24.2208 k = 1.0000-0.2211 0.5082 ( 524 PWs) bands (ev): -6.5696 -6.5696 -5.6306 -5.6306 -1.4988 -1.4988 4.7847 4.7847 8.0637 8.0637 17.3253 17.3253 18.9534 18.9534 24.1078 24.1078 k = 1.0000-0.2141 0.5183 ( 524 PWs) bands (ev): -6.5272 -6.5272 -5.5946 -5.5946 -1.6403 -1.6403 4.8470 4.8470 8.0534 8.0534 17.5158 17.5158 18.8370 18.8370 23.9959 23.9959 k = 1.0000-0.2072 0.5285 ( 520 PWs) bands (ev): -6.4828 -6.4828 -5.5580 -5.5580 -1.7825 -1.7825 4.9118 4.9118 8.0412 8.0412 17.7060 17.7060 18.7231 18.7231 23.8852 23.8852 k = 1.0000-0.2003 0.5386 ( 520 PWs) bands (ev): -6.4369 -6.4369 -5.5212 -5.5212 -1.9247 -1.9247 4.9791 4.9791 8.0267 8.0267 17.8948 17.8948 18.6121 18.6121 23.7755 23.7755 k = 1.0000-0.1933 0.5487 ( 520 PWs) bands (ev): -6.3892 -6.3892 -5.4845 -5.4845 -2.0665 -2.0665 5.0489 5.0489 8.0099 8.0099 18.0812 18.0812 18.5046 18.5046 23.6668 23.6668 k = 1.0000-0.1864 0.5589 ( 518 PWs) bands (ev): -6.3398 -6.3398 -5.4483 -5.4483 -2.2073 -2.2073 5.1211 5.1211 7.9905 7.9905 18.2641 18.2641 18.4009 18.4009 23.5593 23.5593 k = 1.0000-0.1795 0.5690 ( 522 PWs) bands (ev): -6.2887 -6.2887 -5.4129 -5.4129 -2.3466 -2.3466 5.1958 5.1958 7.9684 7.9684 18.3014 18.3014 18.4421 18.4421 23.4526 23.4526 k = 1.0000-0.1725 0.5791 ( 522 PWs) bands (ev): -6.2359 -6.2359 -5.3788 -5.3788 -2.4834 -2.4834 5.2730 5.2730 7.9435 7.9435 18.2067 18.2067 18.6139 18.6139 23.3472 23.3472 k = 1.0000-0.1656 0.5893 ( 526 PWs) bands (ev): -6.1814 -6.1814 -5.3469 -5.3469 -2.6173 -2.6173 5.3526 5.3526 7.9151 7.9151 18.1168 18.1168 18.7778 18.7778 23.2428 23.2428 k = 1.0000-0.1587 0.5994 ( 530 PWs) bands (ev): -6.1251 -6.1251 -5.3177 -5.3177 -2.7470 -2.7470 5.4346 5.4346 7.8839 7.8839 18.0324 18.0324 18.9324 18.9324 23.1395 23.1395 k = 1.0000-0.1517 0.6095 ( 530 PWs) bands (ev): -6.0672 -6.0672 -5.2924 -5.2924 -2.8714 -2.8714 5.5192 5.5192 7.8494 7.8494 17.9540 17.9540 19.0760 19.0760 23.0373 23.0373 k = 1.0000-0.1448 0.6197 ( 526 PWs) bands (ev): -6.0075 -6.0075 -5.2721 -5.2721 -2.9892 -2.9892 5.6061 5.6061 7.8114 7.8114 17.8816 17.8816 19.2075 19.2075 22.9363 22.9363 k = 0.0000 0.6692 0.9783 ( 526 PWs) bands (ev): -6.0075 -6.0075 -5.2721 -5.2721 -2.9892 -2.9892 5.6061 5.6061 7.8114 7.8114 17.8816 17.8816 19.2075 19.2075 22.9363 22.9363 k = 0.0100 0.6720 0.9712 ( 524 PWs) bands (ev): -5.9861 -5.9861 -5.2665 -5.2665 -3.0289 -3.0289 5.6388 5.6388 7.7974 7.7974 17.8546 17.8546 19.2541 19.2541 22.8971 22.8971 k = 0.0200 0.6748 0.9640 ( 525 PWs) bands (ev): -5.9650 -5.9650 -5.2619 -5.2619 -3.0676 -3.0676 5.6741 5.6741 7.7835 7.7835 17.8232 17.8232 19.3064 19.3064 22.8507 22.8507 k = 0.0300 0.6776 0.9568 ( 527 PWs) bands (ev): -5.9441 -5.9441 -5.2585 -5.2585 -3.1049 -3.1049 5.7121 5.7121 7.7693 7.7693 17.7878 17.7878 19.3641 19.3641 22.7977 22.7977 k = 0.0400 0.6803 0.9497 ( 523 PWs) bands (ev): -5.9233 -5.9233 -5.2561 -5.2561 -3.1409 -3.1409 5.7528 5.7528 7.7548 7.7548 17.7491 17.7491 19.4272 19.4272 22.7398 22.7398 k = 0.0500 0.6831 0.9425 ( 523 PWs) bands (ev): -5.9028 -5.9028 -5.2549 -5.2549 -3.1755 -3.1755 5.7960 5.7960 7.7397 7.7397 17.7077 17.7077 19.4953 19.4953 22.6763 22.6763 k = 0.0600 0.6859 0.9353 ( 523 PWs) bands (ev): -5.8824 -5.8824 -5.2549 -5.2549 -3.2086 -3.2086 5.8419 5.8419 7.7239 7.7239 17.6646 17.6646 19.5683 19.5683 22.6080 22.6080 k = 0.0700 0.6887 0.9281 ( 523 PWs) bands (ev): -5.8622 -5.8622 -5.2561 -5.2561 -3.2403 -3.2403 5.8903 5.8903 7.7074 7.7074 17.6204 17.6204 19.6458 19.6458 22.5353 22.5353 k = 0.0800 0.6915 0.9210 ( 523 PWs) bands (ev): -5.8421 -5.8421 -5.2585 -5.2585 -3.2705 -3.2705 5.9412 5.9412 7.6898 7.6898 17.5760 17.5760 19.7276 19.7276 22.4586 22.4586 k = 0.0900 0.6943 0.9138 ( 521 PWs) bands (ev): -5.8221 -5.8221 -5.2623 -5.2623 -3.2991 -3.2991 5.9947 5.9947 7.6711 7.6711 17.5320 17.5320 19.8135 19.8135 22.3783 22.3783 k = 0.1000 0.6971 0.9066 ( 521 PWs) bands (ev): -5.8022 -5.8022 -5.2674 -5.2674 -3.3261 -3.3261 6.0505 6.0505 7.6510 7.6510 17.4892 17.4892 19.9032 19.9032 22.2947 22.2947 k = 0.1100 0.6999 0.8994 ( 521 PWs) bands (ev): -5.7824 -5.7824 -5.2738 -5.2738 -3.3515 -3.3515 6.1085 6.1085 7.6295 7.6295 17.4483 17.4483 19.9965 19.9965 22.2081 22.2081 k = 0.1200 0.7027 0.8923 ( 523 PWs) bands (ev): -5.7628 -5.7628 -5.2816 -5.2816 -3.3752 -3.3752 6.1686 6.1686 7.6062 7.6062 17.4097 17.4097 20.0931 20.0931 22.1187 22.1187 k = 0.1300 0.7055 0.8851 ( 523 PWs) bands (ev): -5.7431 -5.7431 -5.2907 -5.2907 -3.3973 -3.3973 6.2310 6.2310 7.5813 7.5813 17.3742 17.3742 20.1930 20.1930 22.0272 22.0272 k = 0.1400 0.7083 0.8779 ( 523 PWs) bands (ev): -5.7235 -5.7235 -5.3011 -5.3011 -3.4176 -3.4176 6.2955 6.2955 7.5544 7.5544 17.3422 17.3422 20.2959 20.2959 21.9338 21.9338 k = 0.1500 0.7110 0.8707 ( 523 PWs) bands (ev): -5.7039 -5.7039 -5.3130 -5.3130 -3.4363 -3.4363 6.3620 6.3620 7.5256 7.5256 17.3143 17.3143 20.4016 20.4016 21.8387 21.8387 k = 0.1600 0.7138 0.8636 ( 523 PWs) bands (ev): -5.6843 -5.6843 -5.3262 -5.3262 -3.4532 -3.4532 6.4304 6.4304 7.4947 7.4947 17.2908 17.2908 20.5099 20.5099 21.7422 21.7422 k = 0.1700 0.7166 0.8564 ( 524 PWs) bands (ev): -5.6646 -5.6646 -5.3407 -5.3407 -3.4684 -3.4684 6.5005 6.5005 7.4615 7.4615 17.2721 17.2721 20.6208 20.6208 21.6448 21.6448 k = 0.1800 0.7194 0.8492 ( 526 PWs) bands (ev): -5.6449 -5.6449 -5.3566 -5.3566 -3.4820 -3.4820 6.5721 6.5721 7.4261 7.4261 17.2585 17.2585 20.7339 20.7339 21.5466 21.5466 k = 0.1900 0.7222 0.8420 ( 524 PWs) bands (ev): -5.6251 -5.6251 -5.3738 -5.3738 -3.4937 -3.4937 6.6455 6.6455 7.3885 7.3885 17.2504 17.2504 20.8492 20.8492 21.4481 21.4481 k = 0.2000 0.7250 0.8349 ( 523 PWs) bands (ev): -5.6052 -5.6052 -5.3923 -5.3923 -3.5038 -3.5038 6.7202 6.7202 7.3487 7.3487 17.2480 17.2480 20.9665 20.9665 21.3495 21.3495 k = 0.2100 0.7278 0.8277 ( 525 PWs) bands (ev): -5.5851 -5.5851 -5.4121 -5.4121 -3.5124 -3.5124 6.7962 6.7962 7.3063 7.3063 17.2513 17.2513 21.0854 21.0854 21.2511 21.2511 k = 0.2200 0.7306 0.8205 ( 525 PWs) bands (ev): -5.5648 -5.5648 -5.4331 -5.4331 -3.5192 -3.5192 6.8733 6.8733 7.2617 7.2617 17.2607 17.2607 21.1530 21.1530 21.2062 21.2062 k = 0.2300 0.7334 0.8134 ( 525 PWs) bands (ev): -5.5444 -5.5444 -5.4552 -5.4552 -3.5244 -3.5244 6.9513 6.9513 7.2149 7.2149 17.2762 17.2762 21.0560 21.0560 21.3279 21.3279 k = 0.2400 0.7362 0.8062 ( 525 PWs) bands (ev): -5.5238 -5.5238 -5.4785 -5.4785 -3.5280 -3.5280 7.0303 7.0303 7.1660 7.1660 17.2979 17.2979 20.9599 20.9599 21.4506 21.4506 k = 0.2500 0.7389 0.7990 ( 525 PWs) bands (ev): -5.5040 -5.5040 -5.5019 -5.5019 -3.5301 -3.5301 7.1099 7.1099 7.1149 7.1149 17.3257 17.3257 20.8653 20.8653 21.5734 21.5734 k = 0.2600 0.7417 0.7918 ( 525 PWs) bands (ev): -5.5286 -5.5286 -5.4817 -5.4817 -3.5307 -3.5307 7.0618 7.0618 7.1900 7.1900 17.3596 17.3596 20.7722 20.7722 21.6950 21.6950 k = 0.2700 0.7445 0.7847 ( 525 PWs) bands (ev): -5.5552 -5.5552 -5.4603 -5.4603 -3.5298 -3.5298 7.0069 7.0069 7.2705 7.2705 17.3996 17.3996 20.6811 20.6811 21.8106 21.8106 k = 0.2800 0.7473 0.7775 ( 525 PWs) bands (ev): -5.5828 -5.5828 -5.4385 -5.4385 -3.5275 -3.5275 6.9502 6.9502 7.3513 7.3513 17.4456 17.4456 20.5922 20.5922 21.8973 21.8973 k = 0.2900 0.7501 0.7703 ( 523 PWs) bands (ev): -5.6114 -5.6114 -5.4164 -5.4164 -3.5238 -3.5238 6.8920 6.8920 7.4321 7.4321 17.4974 17.4974 20.5057 20.5057 21.8819 21.8819 k = 0.3000 0.7529 0.7631 ( 519 PWs) bands (ev): -5.6410 -5.6410 -5.3939 -5.3939 -3.5187 -3.5187 6.8323 6.8323 7.5128 7.5128 17.5548 17.5548 20.4220 20.4220 21.7917 21.7917 k = 0.3100 0.7557 0.7560 ( 519 PWs) bands (ev): -5.6714 -5.6714 -5.3711 -5.3711 -3.5123 -3.5123 6.7714 6.7714 7.5931 7.5931 17.6177 17.6177 20.3411 20.3411 21.6846 21.6846 k = 0.3200 0.7585 0.7488 ( 515 PWs) bands (ev): -5.7028 -5.7028 -5.3479 -5.3479 -3.5046 -3.5046 6.7094 6.7094 7.6732 7.6732 17.6860 17.6860 20.2634 20.2634 21.5729 21.5729 k = 0.3300 0.7613 0.7416 ( 517 PWs) bands (ev): -5.7350 -5.7350 -5.3243 -5.3243 -3.4958 -3.4958 6.6463 6.6463 7.7522 7.7522 17.7591 17.7591 20.1888 20.1888 21.4593 21.4593 k = 0.3400 0.7641 0.7344 ( 517 PWs) bands (ev): -5.7680 -5.7680 -5.3003 -5.3003 -3.4856 -3.4856 6.5826 6.5826 7.8305 7.8305 17.8368 17.8368 20.1181 20.1181 21.3450 21.3450 k = 0.3500 0.7669 0.7273 ( 514 PWs) bands (ev): -5.8019 -5.8019 -5.2758 -5.2758 -3.4743 -3.4743 6.5184 6.5184 7.9077 7.9077 17.9188 17.9188 20.0511 20.0511 21.2305 21.2305 k = 0.3600 0.7696 0.7201 ( 514 PWs) bands (ev): -5.8365 -5.8365 -5.2509 -5.2509 -3.4618 -3.4618 6.4537 6.4537 7.9837 7.9837 18.0049 18.0049 19.9881 19.9881 21.1162 21.1162 k = 0.3700 0.7724 0.7129 ( 514 PWs) bands (ev): -5.8719 -5.8719 -5.2255 -5.2255 -3.4483 -3.4483 6.3888 6.3888 8.0583 8.0583 18.0945 18.0945 19.9292 19.9292 21.0023 21.0023 k = 0.3800 0.7752 0.7058 ( 514 PWs) bands (ev): -5.9081 -5.9081 -5.1996 -5.1996 -3.4336 -3.4336 6.3239 6.3239 8.1314 8.1314 18.1872 18.1872 19.8747 19.8747 20.8890 20.8890 k = 0.3900 0.7780 0.6986 ( 512 PWs) bands (ev): -5.9449 -5.9449 -5.1732 -5.1732 -3.4178 -3.4178 6.2592 6.2592 8.2027 8.2027 18.2826 18.2826 19.8246 19.8246 20.7767 20.7767 k = 0.4000 0.7808 0.6914 ( 511 PWs) bands (ev): -5.9825 -5.9825 -5.1463 -5.1463 -3.4011 -3.4011 6.1949 6.1949 8.2722 8.2722 18.3802 18.3802 19.7790 19.7790 20.6655 20.6655 k = 0.4100 0.7836 0.6842 ( 511 PWs) bands (ev): -6.0208 -6.0208 -5.1189 -5.1189 -3.3833 -3.3833 6.1310 6.1310 8.3396 8.3396 18.4792 18.4792 19.7381 19.7381 20.5558 20.5558 k = 0.4200 0.7864 0.6771 ( 513 PWs) bands (ev): -6.0598 -6.0598 -5.0910 -5.0910 -3.3646 -3.3646 6.0678 6.0678 8.4048 8.4048 18.5791 18.5791 19.7020 19.7020 20.4480 20.4480 k = 0.4300 0.7892 0.6699 ( 515 PWs) bands (ev): -6.0995 -6.0995 -5.0625 -5.0625 -3.3449 -3.3449 6.0054 6.0054 8.4678 8.4678 18.6788 18.6788 19.6706 19.6706 20.3426 20.3426 k = 0.4400 0.7920 0.6627 ( 517 PWs) bands (ev): -6.1398 -6.1398 -5.0335 -5.0335 -3.3243 -3.3243 5.9438 5.9438 8.5283 8.5283 18.7775 18.7775 19.6439 19.6439 20.2402 20.2402 k = 0.4500 0.7948 0.6555 ( 517 PWs) bands (ev): -6.1808 -6.1808 -5.0040 -5.0040 -3.3028 -3.3028 5.8835 5.8835 8.5864 8.5864 18.8735 18.8735 19.6221 19.6221 20.1420 20.1420 k = 0.4600 0.7975 0.6484 ( 517 PWs) bands (ev): -6.2224 -6.2224 -4.9739 -4.9739 -3.2804 -3.2804 5.8244 5.8244 8.6420 8.6420 18.9650 18.9650 19.6051 19.6051 20.0496 20.0496 k = 0.4700 0.8003 0.6412 ( 519 PWs) bands (ev): -6.2646 -6.2646 -4.9433 -4.9433 -3.2571 -3.2571 5.7666 5.7666 8.6948 8.6948 19.0488 19.0488 19.5928 19.5928 19.9655 19.9655 k = 0.4800 0.8031 0.6340 ( 517 PWs) bands (ev): -6.3074 -6.3074 -4.9121 -4.9121 -3.2330 -3.2330 5.7105 5.7105 8.7450 8.7450 19.1202 19.1202 19.5851 19.5851 19.8941 19.8941 k = 0.4900 0.8059 0.6268 ( 518 PWs) bands (ev): -6.3508 -6.3508 -4.8803 -4.8803 -3.2080 -3.2080 5.6557 5.6557 8.7924 8.7924 19.1721 19.1721 19.5820 19.5820 19.8420 19.8420 k = 0.5000 0.8087 0.6197 ( 520 PWs) bands (ev): -6.3950 -6.3950 -4.8481 -4.8481 -3.1822 -3.1822 5.6026 5.6026 8.8371 8.8371 19.1960 19.1960 19.5832 19.5832 19.8170 19.8170 k = 0.5000 0.8087 0.6197 ( 520 PWs) bands (ev): -6.3950 -6.3950 -4.8481 -4.8481 -3.1822 -3.1822 5.6026 5.6026 8.8371 8.8371 19.1960 19.1960 19.5832 19.5832 19.8170 19.8170 k = 0.5000 0.8016 0.6093 ( 518 PWs) bands (ev): -6.5241 -6.5241 -4.7530 -4.7530 -3.1041 -3.1041 5.4513 5.4513 8.9635 8.9635 19.2195 19.2195 19.5918 19.5918 19.7872 19.7872 k = 0.5000 0.7945 0.5989 ( 518 PWs) bands (ev): -6.6546 -6.6546 -4.6562 -4.6562 -3.0218 -3.0218 5.2996 5.2996 9.0920 9.0920 19.2449 19.2449 19.5980 19.5980 19.7514 19.7514 k = 0.5000 0.7874 0.5885 ( 518 PWs) bands (ev): -6.7859 -6.7859 -4.5577 -4.5577 -2.9357 -2.9357 5.1477 5.1477 9.2225 9.2225 19.2720 19.2720 19.6018 19.6018 19.7098 19.7098 k = 0.5000 0.7803 0.5782 ( 522 PWs) bands (ev): -6.9178 -6.9178 -4.4576 -4.4576 -2.8462 -2.8462 4.9957 4.9957 9.3549 9.3549 19.3003 19.3003 19.6031 19.6031 19.6625 19.6625 k = 0.5000 0.7732 0.5678 ( 518 PWs) bands (ev): -7.0499 -7.0499 -4.3557 -4.3557 -2.7536 -2.7536 4.8438 4.8438 9.4893 9.4893 19.3296 19.3296 19.6017 19.6017 19.6105 19.6105 k = 0.5000 0.7661 0.5574 ( 518 PWs) bands (ev): -7.1818 -7.1818 -4.2521 -4.2521 -2.6582 -2.6582 4.6920 4.6920 9.6256 9.6256 19.3590 19.3590 19.5519 19.5519 19.5995 19.5995 k = 0.5000 0.7590 0.5470 ( 518 PWs) bands (ev): -7.3133 -7.3133 -4.1468 -4.1468 -2.5602 -2.5602 4.5406 4.5406 9.7638 9.7638 19.3884 19.3884 19.4893 19.4893 19.5941 19.5941 k = 0.5000 0.7519 0.5367 ( 512 PWs) bands (ev): -7.4443 -7.4443 -4.0397 -4.0397 -2.4597 -2.4597 4.3896 4.3896 9.9039 9.9039 19.4174 19.4174 19.4223 19.4223 19.5867 19.5867 k = 0.5000 0.7448 0.5263 ( 512 PWs) bands (ev): -7.5746 -7.5746 -3.9311 -3.9311 -2.3572 -2.3572 4.2392 4.2392 10.0457 10.0457 19.3509 19.3509 19.4456 19.4456 19.5770 19.5770 k = 0.5000 0.7377 0.5159 ( 512 PWs) bands (ev): -7.7040 -7.7040 -3.8209 -3.8209 -2.2526 -2.2526 4.0895 4.0895 10.1893 10.1893 19.2759 19.2759 19.4724 19.4724 19.5653 19.5653 k = 0.5000 0.7306 0.5055 ( 512 PWs) bands (ev): -7.8324 -7.8324 -3.7091 -3.7091 -2.1461 -2.1461 3.9407 3.9407 10.3345 10.3345 19.1975 19.1975 19.4977 19.4977 19.5515 19.5515 k = 0.5000 0.7235 0.4952 ( 512 PWs) bands (ev): -7.9598 -7.9598 -3.5956 -3.5956 -2.0379 -2.0379 3.7927 3.7927 10.4815 10.4815 19.1160 19.1160 19.5209 19.5209 19.5360 19.5360 k = 0.5000 0.7164 0.4848 ( 512 PWs) bands (ev): -8.0860 -8.0860 -3.4806 -3.4806 -1.9279 -1.9279 3.6457 3.6457 10.6301 10.6301 19.0318 19.0318 19.5182 19.5182 19.5422 19.5422 k = 0.5000 0.7093 0.4744 ( 512 PWs) bands (ev): -8.2109 -8.2109 -3.3640 -3.3640 -1.8164 -1.8164 3.4999 3.4999 10.7802 10.7802 18.9454 18.9454 19.4989 19.4989 19.5604 19.5604 k = 0.5000 0.7022 0.4640 ( 512 PWs) bands (ev): -8.3344 -8.3344 -3.2458 -3.2458 -1.7034 -1.7034 3.3553 3.3553 10.9319 10.9319 18.8569 18.8569 19.4779 19.4779 19.5758 19.5758 k = 0.5000 0.6951 0.4536 ( 516 PWs) bands (ev): -8.4566 -8.4566 -3.1261 -3.1261 -1.5890 -1.5890 3.2118 3.2118 11.0849 11.0849 18.7666 18.7666 19.4553 19.4553 19.5879 19.5879 k = 0.5000 0.6880 0.4433 ( 518 PWs) bands (ev): -8.5774 -8.5774 -3.0049 -3.0049 -1.4734 -1.4734 3.0696 3.0696 11.2395 11.2395 18.6751 18.6751 19.4311 19.4311 19.5966 19.5966 k = 0.5000 0.6809 0.4329 ( 518 PWs) bands (ev): -8.6966 -8.6966 -2.8821 -2.8821 -1.3565 -1.3565 2.9290 2.9290 11.3954 11.3954 18.5826 18.5826 19.4054 19.4054 19.6017 19.6017 k = 0.5000 0.6739 0.4225 ( 522 PWs) bands (ev): -8.8142 -8.8142 -2.7580 -2.7580 -1.2385 -1.2385 2.7899 2.7899 11.5525 11.5525 18.4894 18.4894 19.3782 19.3782 19.6030 19.6030 k = 0.5000 0.6668 0.4121 ( 526 PWs) bands (ev): -8.9302 -8.9302 -2.6324 -2.6324 -1.1195 -1.1195 2.6524 2.6524 11.7110 11.7110 18.3952 18.3952 19.3494 19.3494 19.6005 19.6005 k = 0.5000 0.6597 0.4018 ( 526 PWs) bands (ev): -9.0446 -9.0446 -2.5053 -2.5053 -0.9995 -0.9995 2.5165 2.5165 11.8705 11.8705 18.3012 18.3012 19.3196 19.3196 19.5941 19.5941 k = 0.5000 0.6526 0.3914 ( 526 PWs) bands (ev): -9.1573 -9.1573 -2.3768 -2.3768 -0.8786 -0.8786 2.3823 2.3823 12.0312 12.0312 18.2071 18.2071 19.2885 19.2885 19.5838 19.5838 k = 0.5000 0.6455 0.3810 ( 526 PWs) bands (ev): -9.2683 -9.2683 -2.2470 -2.2470 -0.7569 -0.7569 2.2498 2.2498 12.1929 12.1929 18.1131 18.1131 19.2562 19.2562 19.5696 19.5696 k = 0.5000 0.6384 0.3706 ( 526 PWs) bands (ev): -9.3775 -9.3775 -2.1159 -2.1159 -0.6344 -0.6344 2.1192 2.1192 12.3556 12.3556 18.0195 18.0195 19.2226 19.2226 19.5517 19.5517 k = 0.5000 0.6313 0.3603 ( 526 PWs) bands (ev): -9.4850 -9.4850 -1.9834 -1.9834 -0.5113 -0.5113 1.9904 1.9904 12.5190 12.5190 17.9264 17.9264 19.1879 19.1879 19.5300 19.5300 k = 0.5000 0.6242 0.3499 ( 526 PWs) bands (ev): -9.5907 -9.5907 -1.8497 -1.8497 -0.3877 -0.3877 1.8635 1.8635 12.6833 12.6833 17.8340 17.8340 19.1521 19.1521 19.5048 19.5048 k = 0.5000 0.6171 0.3395 ( 526 PWs) bands (ev): -9.6946 -9.6946 -1.7148 -1.7148 -0.2636 -0.2636 1.7385 1.7385 12.8483 12.8483 17.7424 17.7424 19.1150 19.1150 19.4762 19.4762 k = 0.5000 0.6100 0.3291 ( 526 PWs) bands (ev): -9.7966 -9.7966 -1.5786 -1.5786 -0.1391 -0.1391 1.6156 1.6156 13.0138 13.0138 17.6518 17.6518 19.0768 19.0768 19.4444 19.4444 k = 0.5000 0.6029 0.3187 ( 526 PWs) bands (ev): -9.8968 -9.8968 -1.4413 -1.4413 -0.0143 -0.0143 1.4946 1.4946 13.1799 13.1799 17.5624 17.5624 19.0374 19.0374 19.4096 19.4096 k = 0.5000 0.5958 0.3084 ( 526 PWs) bands (ev): -9.9951 -9.9951 -1.3030 -1.3030 0.1108 0.1108 1.3758 1.3758 13.3464 13.3464 17.4741 17.4741 18.9968 18.9968 19.3721 19.3721 k = 0.5000 0.5887 0.2980 ( 524 PWs) bands (ev): -10.0916 -10.0916 -1.1634 -1.1634 0.2360 0.2360 1.2589 1.2589 13.5131 13.5131 17.3871 17.3871 18.9550 18.9550 19.3321 19.3321 k = 0.5000 0.5816 0.2876 ( 524 PWs) bands (ev): -10.1861 -10.1861 -1.0230 -1.0230 0.3612 0.3612 1.1443 1.1443 13.6801 13.6801 17.3016 17.3016 18.9118 18.9118 19.2898 19.2898 k = 0.5000 0.5745 0.2772 ( 524 PWs) bands (ev): -10.2787 -10.2787 -0.8816 -0.8816 0.4863 0.4863 1.0318 1.0318 13.8471 13.8471 17.2177 17.2177 18.8672 18.8672 19.2455 19.2455 k = 0.5000 0.5674 0.2669 ( 524 PWs) bands (ev): -10.3694 -10.3694 -0.7394 -0.7394 0.6113 0.6113 0.9216 0.9216 14.0140 14.0140 17.1353 17.1353 18.8213 18.8213 19.1994 19.1994 k = 0.5000 0.5603 0.2565 ( 524 PWs) bands (ev): -10.4581 -10.4581 -0.5964 -0.5964 0.7359 0.7359 0.8135 0.8135 14.1808 14.1808 17.0547 17.0547 18.7737 18.7737 19.1518 19.1518 k = 0.5000 0.5532 0.2461 ( 524 PWs) bands (ev): -10.5448 -10.5448 -0.4526 -0.4526 0.7077 0.7077 0.8602 0.8602 14.3473 14.3473 16.9759 16.9759 18.7246 18.7246 19.1028 19.1028 k = 0.5000 0.5461 0.2357 ( 524 PWs) bands (ev): -10.6296 -10.6296 -0.3081 -0.3081 0.6042 0.6042 0.9841 0.9841 14.5134 14.5134 16.8989 16.8989 18.6736 18.6736 19.0528 19.0528 k = 0.5000 0.5390 0.2254 ( 522 PWs) bands (ev): -10.7124 -10.7124 -0.1630 -0.1630 0.5030 0.5030 1.1073 1.1073 14.6788 14.6788 16.8238 16.8238 18.6208 18.6208 19.0018 19.0018 k = 0.5000 0.5319 0.2150 ( 518 PWs) bands (ev): -10.7931 -10.7931 -0.0171 -0.0171 0.4041 0.4041 1.2301 1.2301 14.8438 14.8438 16.7507 16.7507 18.5659 18.5659 18.9503 18.9503 k = 0.5000 0.5248 0.2046 ( 518 PWs) bands (ev): -10.8719 -10.8719 0.1288 0.1288 0.3076 0.3076 1.3518 1.3518 15.0076 15.0076 16.6796 16.6796 18.5088 18.5088 18.8982 18.8982 k = 0.5000 0.5177 0.1942 ( 522 PWs) bands (ev): -10.9488 -10.9488 0.2132 0.2132 0.2751 0.2751 1.4726 1.4726 15.1704 15.1704 16.6104 16.6104 18.4492 18.4492 18.8457 18.8457 k = 0.5000 0.5106 0.1839 ( 522 PWs) bands (ev): -11.0236 -11.0236 0.1215 0.1215 0.4216 0.4216 1.5923 1.5923 15.3321 15.3321 16.5434 16.5434 18.3871 18.3871 18.7932 18.7932 k = 0.5000 0.5035 0.1735 ( 522 PWs) bands (ev): -11.0963 -11.0963 0.0321 0.0321 0.5682 0.5682 1.7108 1.7108 15.4924 15.4924 16.4785 16.4785 18.3223 18.3223 18.7408 18.7408 k = 0.5000 0.4964 0.1631 ( 522 PWs) bands (ev): -11.1670 -11.1670 -0.0548 -0.0548 0.7147 0.7147 1.8280 1.8280 15.6511 15.6511 16.4158 16.4158 18.2544 18.2544 18.6886 18.6886 k = 0.5000 0.4893 0.1527 ( 522 PWs) bands (ev): -11.2356 -11.2356 -0.1393 -0.1393 0.8612 0.8612 1.9438 1.9438 15.8082 15.8082 16.3553 16.3553 18.1834 18.1834 18.6368 18.6368 k = 0.5000 0.4822 0.1423 ( 522 PWs) bands (ev): -11.3022 -11.3022 -0.2214 -0.2214 1.0073 1.0073 2.0579 2.0579 15.9633 15.9633 16.2970 16.2970 18.1091 18.1091 18.5854 18.5854 k = 0.5000 0.4751 0.1320 ( 518 PWs) bands (ev): -11.3667 -11.3667 -0.3009 -0.3009 1.1530 1.1530 2.1706 2.1706 16.1167 16.1167 16.2410 16.2410 18.0314 18.0314 18.5348 18.5348 k = 0.5000 0.4680 0.1216 ( 518 PWs) bands (ev): -11.4292 -11.4292 -0.3780 -0.3780 1.2981 1.2981 2.2813 2.2813 16.1870 16.1870 16.2676 16.2676 17.9499 17.9499 18.4848 18.4848 k = 0.5000 0.4609 0.1112 ( 518 PWs) bands (ev): -11.4896 -11.4896 -0.4526 -0.4526 1.4425 1.4425 2.3899 2.3899 16.1355 16.1355 16.4159 16.4159 17.8648 17.8648 18.4357 18.4357 k = 0.5000 0.4538 0.1008 ( 518 PWs) bands (ev): -11.5479 -11.5479 -0.5246 -0.5246 1.5859 1.5859 2.4965 2.4965 16.0861 16.0861 16.5615 16.5615 17.7759 17.7759 18.3876 18.3876 k = 0.5000 0.4467 0.0905 ( 522 PWs) bands (ev): -11.6041 -11.6041 -0.5941 -0.5941 1.7280 1.7280 2.6008 2.6008 16.0390 16.0390 16.7043 16.7043 17.6833 17.6833 18.3406 18.3406 k = 0.5000 0.4396 0.0801 ( 518 PWs) bands (ev): -11.6583 -11.6583 -0.6611 -0.6611 1.8692 1.8692 2.7027 2.7027 15.9941 15.9941 16.8443 16.8443 17.5872 17.5872 18.2947 18.2947 k = 0.5000 0.4325 0.0697 ( 518 PWs) bands (ev): -11.7103 -11.7103 -0.7256 -0.7256 2.0086 2.0086 2.8020 2.8020 15.9514 15.9514 16.9807 16.9807 17.4877 17.4877 18.2501 18.2501 k = 0.5000 0.4254 0.0593 ( 522 PWs) bands (ev): -11.7603 -11.7603 -0.7875 -0.7875 2.1461 2.1461 2.8987 2.8987 15.9109 15.9109 17.1133 17.1133 17.3852 17.3852 18.2067 18.2067 k = 0.5000 0.4183 0.0490 ( 522 PWs) bands (ev): -11.8082 -11.8082 -0.8468 -0.8468 2.2816 2.2816 2.9925 2.9925 15.8726 15.8726 17.2425 17.2425 17.2799 17.2799 18.1647 18.1647 k = 0.5000 0.4112 0.0386 ( 522 PWs) bands (ev): -11.8539 -11.8539 -0.9036 -0.9036 2.4147 2.4147 3.0834 3.0834 15.8365 15.8365 17.1724 17.1724 17.3678 17.3678 18.1243 18.1243 k = 0.5000 0.4041 0.0282 ( 522 PWs) bands (ev): -11.8976 -11.8976 -0.9577 -0.9577 2.5453 2.5453 3.1711 3.1711 15.8025 15.8025 17.0632 17.0632 17.4889 17.4889 18.0853 18.0853 k = 0.5000 0.3970 0.0178 ( 522 PWs) bands (ev): -11.9391 -11.9391 -1.0093 -1.0093 2.6729 2.6729 3.2556 3.2556 15.7706 15.7706 16.9528 16.9528 17.6057 17.6057 18.0480 18.0480 k = 0.5000 0.3899 0.0074 ( 522 PWs) bands (ev): -11.9786 -11.9786 -1.0582 -1.0582 2.7974 2.7974 3.3367 3.3367 15.7408 15.7408 16.8420 16.8420 17.7180 17.7180 18.0123 18.0123 k = 0.5000 0.3828-0.0029 ( 522 PWs) bands (ev): -12.0159 -12.0159 -1.1046 -1.1046 2.9182 2.9182 3.4144 3.4144 15.7130 15.7130 16.7314 16.7314 17.8255 17.8255 17.9782 17.9782 k = 0.5000 0.3757-0.0133 ( 522 PWs) bands (ev): -12.0511 -12.0511 -1.1483 -1.1483 3.0352 3.0352 3.4883 3.4883 15.6871 15.6871 16.6219 16.6219 17.9281 17.9281 17.9459 17.9459 k = 0.5000 0.3687-0.0237 ( 522 PWs) bands (ev): -12.0842 -12.0842 -1.1894 -1.1894 3.1478 3.1478 3.5585 3.5585 15.6632 15.6632 16.5140 16.5140 17.9154 17.9154 18.0255 18.0255 k = 0.5000 0.3616-0.0341 ( 526 PWs) bands (ev): -12.1152 -12.1152 -1.2279 -1.2279 3.2555 3.2555 3.6247 3.6247 15.6406 15.6406 16.4083 16.4083 17.8866 17.8866 18.1177 18.1177 k = 0.5000 0.3545-0.0444 ( 526 PWs) bands (ev): -12.1440 -12.1440 -1.2637 -1.2637 3.3584 3.3584 3.6870 3.6870 15.6204 15.6204 16.3062 16.3062 17.8597 17.8597 18.2043 18.2043 k = 0.5000 0.3474-0.0548 ( 526 PWs) bands (ev): -12.1707 -12.1707 -1.2969 -1.2969 3.4559 3.4559 3.7451 3.7451 15.6019 15.6019 16.2080 16.2080 17.8347 17.8347 18.2852 18.2852 k = 0.5000 0.3403-0.0652 ( 530 PWs) bands (ev): -12.1953 -12.1953 -1.3275 -1.3275 3.5475 3.5475 3.7988 3.7988 15.5851 15.5851 16.1145 16.1145 17.8116 17.8116 18.3602 18.3602 k = 0.5000 0.3332-0.0756 ( 530 PWs) bands (ev): -12.2177 -12.2177 -1.3554 -1.3554 3.6329 3.6329 3.8484 3.8484 15.5700 15.5700 16.0265 16.0265 17.7904 17.7904 18.4293 18.4293 k = 0.5000 0.3261-0.0859 ( 526 PWs) bands (ev): -12.2380 -12.2380 -1.3807 -1.3807 3.7118 3.7118 3.8936 3.8936 15.5567 15.5567 15.9446 15.9446 17.7712 17.7712 18.4928 18.4928 k = 0.5000 0.3190-0.0963 ( 526 PWs) bands (ev): -12.2562 -12.2562 -1.4033 -1.4033 3.7835 3.7835 3.9342 3.9342 15.5448 15.5448 15.8695 15.8695 17.7540 17.7540 18.5495 18.5495 k = 0.5000 0.3119-0.1067 ( 522 PWs) bands (ev): -12.2722 -12.2722 -1.4232 -1.4232 3.8478 3.8478 3.9703 3.9703 15.5345 15.5345 15.8019 15.8019 17.7388 17.7388 18.5998 18.5998 k = 0.5000 0.3048-0.1171 ( 522 PWs) bands (ev): -12.2861 -12.2861 -1.4406 -1.4406 3.9042 3.9042 4.0017 4.0017 15.5257 15.5257 15.7420 15.7420 17.7255 17.7255 18.6436 18.6436 k = 0.5000 0.2977-0.1275 ( 522 PWs) bands (ev): -12.2978 -12.2978 -1.4552 -1.4552 3.9525 3.9525 4.0284 4.0284 15.5182 15.5182 15.6903 15.6903 17.7142 17.7142 18.6808 18.6808 k = 0.5000 0.2906-0.1378 ( 526 PWs) bands (ev): -12.3075 -12.3075 -1.4672 -1.4672 3.9924 3.9924 4.0502 4.0502 15.5121 15.5121 15.6475 15.6475 17.7050 17.7050 18.7112 18.7112 k = 0.5000 0.2835-0.1482 ( 524 PWs) bands (ev): -12.3149 -12.3149 -1.4765 -1.4765 4.0236 4.0236 4.0674 4.0674 15.5077 15.5077 15.6138 15.6138 17.6978 17.6978 18.7351 18.7351 k = 0.5000 0.2764-0.1586 ( 520 PWs) bands (ev): -12.3203 -12.3203 -1.4832 -1.4832 4.0465 4.0465 4.0799 4.0799 15.5048 15.5048 15.5897 15.5897 17.6927 17.6927 18.7522 18.7522 k = 0.5000 0.2693-0.1690 ( 520 PWs) bands (ev): -12.3235 -12.3235 -1.4872 -1.4872 4.0599 4.0599 4.0874 4.0874 15.5028 15.5028 15.5751 15.5751 17.6896 17.6896 18.7625 18.7625 k = 0.5000 0.2622-0.1793 ( 520 PWs) bands (ev): -12.3246 -12.3246 -1.4885 -1.4885 4.0644 4.0644 4.0899 4.0899 15.5021 15.5021 15.5702 15.5702 17.6886 17.6886 18.7659 18.7659 k = 0.5000 0.2622 0.7990 ( 530 PWs) bands (ev): -7.1859 -7.1859 -6.1914 -6.1914 0.6612 0.6612 4.7290 4.7290 8.7725 8.7725 14.6493 14.6493 19.7166 19.7166 20.8654 20.8654 k = 0.4936 0.2588 0.7888 ( 528 PWs) bands (ev): -7.2057 -7.2057 -6.1702 -6.1702 0.6622 0.6622 4.7239 4.7239 8.7795 8.7795 14.6498 14.6498 19.6921 19.6921 20.8880 20.8880 k = 0.4872 0.2555 0.7785 ( 528 PWs) bands (ev): -7.2607 -7.2607 -6.1109 -6.1109 0.6652 0.6652 4.7085 4.7085 8.8005 8.8005 14.6513 14.6513 19.6238 19.6238 20.9505 20.9505 k = 0.4808 0.2521 0.7683 ( 528 PWs) bands (ev): -7.3414 -7.3414 -6.0232 -6.0232 0.6701 0.6701 4.6832 4.6832 8.8352 8.8352 14.6537 14.6537 19.5227 19.5227 21.0420 21.0420 k = 0.4744 0.2487 0.7580 ( 530 PWs) bands (ev): -7.4389 -7.4389 -5.9158 -5.9158 0.6769 0.6769 4.6485 4.6485 8.8830 8.8830 14.6572 14.6572 19.3993 19.3993 21.1520 21.1520 k = 0.4679 0.2454 0.7478 ( 532 PWs) bands (ev): -7.5467 -7.5467 -5.7953 -5.7953 0.6856 0.6856 4.6050 4.6050 8.9433 8.9433 14.6616 14.6616 19.2611 19.2611 21.2731 21.2731 k = 0.4615 0.2420 0.7375 ( 533 PWs) bands (ev): -7.6608 -7.6608 -5.6658 -5.6658 0.6964 0.6964 4.5537 4.5537 9.0152 9.0152 14.6669 14.6669 19.1130 19.1130 21.4005 21.4005 k = 0.4551 0.2387 0.7273 ( 534 PWs) bands (ev): -7.7786 -7.7786 -5.5297 -5.5297 0.7090 0.7090 4.4951 4.4951 9.0980 9.0980 14.6732 14.6732 18.9581 18.9581 21.5310 21.5310 k = 0.4487 0.2353 0.7171 ( 531 PWs) bands (ev): -7.8985 -7.8985 -5.3886 -5.3886 0.7236 0.7236 4.4303 4.4303 9.1908 9.1908 14.6805 14.6805 18.7986 18.7986 21.6629 21.6629 k = 0.4423 0.2319 0.7068 ( 529 PWs) bands (ev): -8.0195 -8.0195 -5.2437 -5.2437 0.7402 0.7402 4.3601 4.3601 9.2928 9.2928 14.6887 14.6887 18.6358 18.6358 21.7949 21.7949 k = 0.4359 0.2286 0.6966 ( 528 PWs) bands (ev): -8.1408 -8.1408 -5.0958 -5.0958 0.7587 0.7587 4.2851 4.2851 9.4030 9.4030 14.6978 14.6978 18.4707 18.4707 21.9259 21.9259 k = 0.4295 0.2252 0.6863 ( 530 PWs) bands (ev): -8.2621 -8.2621 -4.9453 -4.9453 0.7790 0.7790 4.2060 4.2060 9.5208 9.5208 14.7077 14.7077 18.3040 18.3040 22.0554 22.0554 k = 0.4231 0.2219 0.6761 ( 528 PWs) bands (ev): -8.3828 -8.3828 -4.7925 -4.7925 0.8014 0.8014 4.1237 4.1237 9.6455 9.6455 14.7185 14.7185 18.1363 18.1363 22.1830 22.1830 k = 0.4167 0.2185 0.6658 ( 527 PWs) bands (ev): -8.5028 -8.5028 -4.6377 -4.6377 0.8256 0.8256 4.0387 4.0387 9.7765 9.7765 14.7301 14.7301 17.9681 17.9681 22.3085 22.3085 k = 0.4103 0.2151 0.6556 ( 528 PWs) bands (ev): -8.6218 -8.6218 -4.4812 -4.4812 0.8516 0.8516 3.9514 3.9514 9.9130 9.9130 14.7425 14.7425 17.7998 17.7998 22.4314 22.4314 k = 0.4038 0.2118 0.6454 ( 528 PWs) bands (ev): -8.7397 -8.7397 -4.3231 -4.3231 0.8795 0.8795 3.8625 3.8625 10.0546 10.0546 14.7556 14.7556 17.6317 17.6317 22.5516 22.5516 k = 0.3974 0.2084 0.6351 ( 527 PWs) bands (ev): -8.8565 -8.8565 -4.1635 -4.1635 0.9092 0.9092 3.7723 3.7723 10.2009 10.2009 14.7693 14.7693 17.4641 17.4641 22.6691 22.6691 k = 0.3910 0.2050 0.6249 ( 527 PWs) bands (ev): -8.9719 -8.9719 -4.0027 -4.0027 0.9408 0.9408 3.6812 3.6812 10.3514 10.3514 14.7837 14.7837 17.2973 17.2973 22.7833 22.7833 k = 0.3846 0.2017 0.6146 ( 525 PWs) bands (ev): -9.0860 -9.0860 -3.8405 -3.8405 0.9743 0.9743 3.5895 3.5895 10.5057 10.5057 14.7986 14.7986 17.1316 17.1316 22.8941 22.8941 k = 0.3782 0.1983 0.6044 ( 523 PWs) bands (ev): -9.1987 -9.1987 -3.6771 -3.6771 1.0094 1.0094 3.4976 3.4976 10.6634 10.6634 14.8139 14.8139 16.9672 16.9672 23.0010 23.0010 k = 0.3718 0.1950 0.5941 ( 522 PWs) bands (ev): -9.3099 -9.3099 -3.5128 -3.5128 1.0464 1.0464 3.4056 3.4056 10.8243 10.8243 14.8296 14.8296 16.8044 16.8044 23.1033 23.1033 k = 0.3654 0.1916 0.5839 ( 523 PWs) bands (ev): -9.4195 -9.4195 -3.3475 -3.3475 1.0850 1.0850 3.3137 3.3137 10.9880 10.9880 14.8452 14.8452 16.6436 16.6436 23.2004 23.2004 k = 0.3590 0.1882 0.5736 ( 523 PWs) bands (ev): -9.5277 -9.5277 -3.1813 -3.1813 1.1255 1.1255 3.2223 3.2223 11.1542 11.1542 14.8607 14.8607 16.4850 16.4850 23.2911 23.2911 k = 0.3526 0.1849 0.5634 ( 523 PWs) bands (ev): -9.6342 -9.6342 -3.0143 -3.0143 1.1676 1.1676 3.1314 3.1314 11.3228 11.3228 14.8758 14.8758 16.3291 16.3291 23.3738 23.3738 k = 0.3462 0.1815 0.5532 ( 524 PWs) bands (ev): -9.7390 -9.7390 -2.8465 -2.8465 1.2114 1.2114 3.0412 3.0412 11.4934 11.4934 14.8900 14.8900 16.1765 16.1765 23.4461 23.4462 k = 0.3397 0.1782 0.5429 ( 523 PWs) bands (ev): -9.8423 -9.8423 -2.6780 -2.6780 1.2570 1.2570 2.9519 2.9519 11.6657 11.6657 14.9025 14.9025 16.0281 16.0281 23.5026 23.5026 k = 0.3333 0.1748 0.5327 ( 522 PWs) bands (ev): -9.9438 -9.9438 -2.5089 -2.5089 1.3041 1.3041 2.8635 2.8635 11.8396 11.8396 14.9122 14.9122 15.8850 15.8850 23.4971 23.4971 k = 0.3269 0.1714 0.5224 ( 524 PWs) bands (ev): -10.0436 -10.0436 -2.3393 -2.3393 1.3528 1.3528 2.7762 2.7762 12.0147 12.0147 14.9172 14.9172 15.7492 15.7492 23.3176 23.3176 k = 0.3205 0.1681 0.5122 ( 522 PWs) bands (ev): -10.1417 -10.1417 -2.1691 -2.1691 1.4030 1.4030 2.6901 2.6901 12.1911 12.1911 14.9146 14.9146 15.6237 15.6237 23.1034 23.1034 k = 0.3141 0.1647 0.5019 ( 522 PWs) bands (ev): -10.2381 -10.2381 -1.9986 -1.9986 1.4548 1.4548 2.6051 2.6051 12.3682 12.3682 14.8997 14.8997 15.5134 15.5134 22.8847 22.8847 k = 0.3077 0.1613 0.4917 ( 520 PWs) bands (ev): -10.3327 -10.3327 -1.8276 -1.8276 1.5080 1.5080 2.5215 2.5215 12.5459 12.5459 14.8662 14.8662 15.4245 15.4245 22.6644 22.6644 k = 0.3013 0.1580 0.4815 ( 520 PWs) bands (ev): -10.4255 -10.4255 -1.6565 -1.6565 1.5627 1.5627 2.4393 2.4393 12.7237 12.7237 14.8094 14.8094 15.3622 15.3622 22.4434 22.4434 k = 0.2949 0.1546 0.4712 ( 518 PWs) bands (ev): -10.5166 -10.5166 -1.4852 -1.4852 1.6188 1.6188 2.3585 2.3585 12.9013 12.9013 14.7297 14.7297 15.3261 15.3261 22.2222 22.2222 k = 0.2885 0.1513 0.4610 ( 516 PWs) bands (ev): -10.6058 -10.6058 -1.3138 -1.3138 1.6764 1.6764 2.2792 2.2792 13.0780 13.0780 14.6334 14.6334 15.3107 15.3107 22.0011 22.0011 k = 0.2821 0.1479 0.4507 ( 516 PWs) bands (ev): -10.6933 -10.6933 -1.1425 -1.1425 1.7351 1.7351 2.2013 2.2013 13.2527 13.2527 14.5281 14.5281 15.3089 15.3089 21.7803 21.7803 k = 0.2756 0.1445 0.4405 ( 516 PWs) bands (ev): -10.7789 -10.7789 -0.9713 -0.9713 1.7950 1.7950 2.1251 2.1251 13.4231 13.4231 14.4209 14.4209 15.3158 15.3158 21.5602 21.5602 k = 0.2692 0.1412 0.4302 ( 516 PWs) bands (ev): -10.8627 -10.8627 -0.8002 -0.8002 1.8560 1.8560 2.0505 2.0505 13.5845 13.5845 14.3198 14.3198 15.3282 15.3282 21.3410 21.3410 k = 0.2628 0.1378 0.4200 ( 520 PWs) bands (ev): -10.9447 -10.9447 -0.6296 -0.6296 1.9175 1.9175 1.9782 1.9782 13.7225 13.7225 14.2406 14.2406 15.3441 15.3441 21.1227 21.1227 k = 0.2564 0.1345 0.4097 ( 520 PWs) bands (ev): -11.0247 -11.0247 -0.4592 -0.4592 1.9047 1.9047 1.9830 1.9830 13.7986 13.7986 14.2232 14.2232 15.3623 15.3623 20.9059 20.9059 k = 0.2500 0.1311 0.3995 ( 520 PWs) bands (ev): -11.1029 -11.1029 -0.2894 -0.2894 1.8355 1.8355 2.0468 2.0468 13.7787 13.7787 14.3022 14.3022 15.3819 15.3819 20.6907 20.6907 k = 0.2436 0.1277 0.3893 ( 520 PWs) bands (ev): -11.1793 -11.1793 -0.1202 -0.1202 1.7675 1.7675 2.1120 2.1120 13.7008 13.7008 14.4397 14.4397 15.4025 15.4025 20.4772 20.4772 k = 0.2372 0.1244 0.3790 ( 520 PWs) bands (ev): -11.2537 -11.2537 0.0483 0.0483 1.7012 1.7012 2.1782 2.1782 13.6028 13.6028 14.5983 14.5983 15.4236 15.4236 20.2657 20.2657 k = 0.2308 0.1210 0.3688 ( 520 PWs) bands (ev): -11.3262 -11.3262 0.2160 0.2160 1.6366 1.6366 2.2451 2.2451 13.4982 13.4982 14.7642 14.7642 15.4449 15.4449 20.0563 20.0563 k = 0.2244 0.1176 0.3585 ( 521 PWs) bands (ev): -11.3969 -11.3969 0.3826 0.3826 1.5737 1.5737 2.3128 2.3128 13.3920 13.3920 14.9327 14.9327 15.4662 15.4662 19.8491 19.8491 k = 0.2179 0.1143 0.3483 ( 520 PWs) bands (ev): -11.4657 -11.4657 0.5482 0.5482 1.5126 1.5126 2.3811 2.3811 13.2860 13.2860 15.1017 15.1017 15.4875 15.4875 19.6444 19.6444 k = 0.2115 0.1109 0.3380 ( 520 PWs) bands (ev): -11.5325 -11.5325 0.7125 0.7125 1.4532 1.4532 2.4499 2.4499 13.1813 13.1813 15.2697 15.2697 15.5088 15.5088 19.4425 19.4425 k = 0.2051 0.1076 0.3278 ( 520 PWs) bands (ev): -11.5974 -11.5974 0.8753 0.8753 1.3956 1.3956 2.5191 2.5191 13.0785 13.0785 15.4341 15.4341 15.5319 15.5319 19.2434 19.2434 k = 0.1987 0.1042 0.3176 ( 522 PWs) bands (ev): -11.6603 -11.6603 1.0366 1.0366 1.3397 1.3397 2.5887 2.5887 12.9779 12.9779 15.5383 15.5383 15.6129 15.6129 19.0473 19.0473 k = 0.1923 0.1008 0.3073 ( 522 PWs) bands (ev): -11.7213 -11.7213 1.1961 1.1961 1.2857 1.2857 2.6584 2.6584 12.8798 12.8798 15.5615 15.5615 15.7720 15.7720 18.8545 18.8545 k = 0.1859 0.0975 0.2971 ( 521 PWs) bands (ev): -11.7804 -11.7804 1.2333 1.2333 1.3540 1.3540 2.7283 2.7283 12.7842 12.7842 15.5797 15.5797 15.9329 15.9329 18.6651 18.6651 k = 0.1795 0.0941 0.2868 ( 521 PWs) bands (ev): -11.8375 -11.8375 1.1828 1.1828 1.5095 1.5095 2.7983 2.7983 12.6914 12.6914 15.5963 15.5963 16.0917 16.0917 18.4788 18.4788 k = 0.1731 0.0908 0.2766 ( 521 PWs) bands (ev): -11.8927 -11.8927 1.1341 1.1341 1.6628 1.6628 2.8680 2.8680 12.6014 12.6014 15.6113 15.6113 16.2479 16.2479 18.2968 18.2968 k = 0.1667 0.0874 0.2663 ( 521 PWs) bands (ev): -11.9459 -11.9459 1.0872 1.0872 1.8137 1.8137 2.9374 2.9374 12.5143 12.5143 15.6249 15.6249 16.4011 16.4011 18.1188 18.1188 k = 0.1603 0.0840 0.2561 ( 521 PWs) bands (ev): -11.9972 -11.9972 1.0420 1.0420 1.9619 1.9619 3.0063 3.0063 12.4301 12.4301 15.6370 15.6370 16.5510 16.5510 17.9450 17.9450 k = 0.1538 0.0807 0.2458 ( 523 PWs) bands (ev): -12.0465 -12.0465 0.9986 0.9986 2.1072 2.1072 3.0747 3.0747 12.3490 12.3490 15.6474 15.6474 16.6974 16.6974 17.7756 17.7756 k = 0.1474 0.0773 0.2356 ( 524 PWs) bands (ev): -12.0938 -12.0938 0.9571 0.9571 2.2494 2.2494 3.1423 3.1423 12.2710 12.2710 15.6563 15.6563 16.8399 16.8399 17.6108 17.6108 k = 0.1410 0.0740 0.2254 ( 522 PWs) bands (ev): -12.1391 -12.1391 0.9174 0.9174 2.3883 2.3883 3.2091 3.2091 12.1961 12.1961 15.6636 15.6636 16.9782 16.9782 17.4512 17.4512 k = 0.1346 0.0706 0.2151 ( 522 PWs) bands (ev): -12.1824 -12.1824 0.8794 0.8794 2.5237 2.5237 3.2748 3.2748 12.1243 12.1243 15.6692 15.6692 17.1104 17.1104 17.2984 17.2984 k = 0.1282 0.0672 0.2049 ( 522 PWs) bands (ev): -12.2237 -12.2237 0.8432 0.8432 2.6552 2.6552 3.3392 3.3392 12.0557 12.0557 15.6732 15.6732 17.1376 17.1376 17.2514 17.2514 k = 0.1218 0.0639 0.1946 ( 522 PWs) bands (ev): -12.2631 -12.2631 0.8088 0.8088 2.7827 2.7827 3.4023 3.4023 11.9903 11.9903 15.6755 15.6755 16.9979 16.9979 17.3722 17.3722 k = 0.1154 0.0605 0.1844 ( 521 PWs) bands (ev): -12.3004 -12.3004 0.7762 0.7762 2.9060 2.9060 3.4637 3.4637 11.9281 11.9281 15.6762 15.6762 16.8597 16.8597 17.4921 17.4921 k = 0.1090 0.0571 0.1741 ( 521 PWs) bands (ev): -12.3358 -12.3358 0.7453 0.7453 3.0246 3.0246 3.5234 3.5234 11.8692 11.8692 15.6754 15.6754 16.7268 16.7268 17.6075 17.6075 k = 0.1026 0.0538 0.1639 ( 519 PWs) bands (ev): -12.3691 -12.3691 0.7163 0.7163 3.1384 3.1384 3.5812 3.5812 11.8136 11.8136 15.6731 15.6731 16.6000 16.6000 17.7180 17.7180 k = 0.0962 0.0504 0.1537 ( 520 PWs) bands (ev): -12.4005 -12.4005 0.6890 0.6890 3.2470 3.2470 3.6365 3.6365 11.7613 11.7613 15.6694 15.6694 16.4789 16.4789 17.8229 17.8229 k = 0.0897 0.0471 0.1434 ( 520 PWs) bands (ev): -12.4298 -12.4298 0.6635 0.6635 3.3503 3.3503 3.6897 3.6897 11.7123 11.7123 15.6644 15.6644 16.3647 16.3647 17.9221 17.9221 k = 0.0833 0.0437 0.1332 ( 520 PWs) bands (ev): -12.4571 -12.4571 0.6398 0.6398 3.4478 3.4478 3.7402 3.7402 11.6666 11.6666 15.6585 15.6585 16.2571 16.2571 18.0154 18.0154 k = 0.0769 0.0403 0.1229 ( 521 PWs) bands (ev): -12.4824 -12.4824 0.6178 0.6178 3.5394 3.5394 3.7879 3.7879 11.6242 11.6242 15.6517 15.6517 16.1565 16.1565 18.1027 18.1027 k = 0.0705 0.0370 0.1127 ( 521 PWs) bands (ev): -12.5057 -12.5057 0.5976 0.5976 3.6248 3.6248 3.8328 3.8328 11.5853 11.5853 15.6441 15.6441 16.0633 16.0633 18.1838 18.1838 k = 0.0641 0.0336 0.1024 ( 521 PWs) bands (ev): -12.5270 -12.5270 0.5792 0.5792 3.7038 3.7038 3.8746 3.8746 11.5496 11.5496 15.6360 15.6360 15.9776 15.9776 18.2585 18.2585 k = 0.0577 0.0303 0.0922 ( 521 PWs) bands (ev): -12.5463 -12.5463 0.5625 0.5625 3.7760 3.7760 3.9131 3.9131 11.5174 11.5174 15.6276 15.6276 15.8997 15.8997 18.3265 18.3265 k = 0.0513 0.0269 0.0819 ( 521 PWs) bands (ev): -12.5635 -12.5635 0.5476 0.5476 3.8412 3.8412 3.9482 3.9482 11.4885 11.4885 15.6188 15.6188 15.8298 15.8298 18.3879 18.3879 k = 0.0449 0.0235 0.0717 ( 521 PWs) bands (ev): -12.5787 -12.5787 0.5344 0.5344 3.8990 3.8990 3.9797 3.9797 11.4630 11.4630 15.6095 15.6095 15.7685 15.7685 18.4424 18.4424 k = 0.0385 0.0202 0.0615 ( 521 PWs) bands (ev): -12.5919 -12.5919 0.5231 0.5231 3.9492 3.9492 4.0078 4.0078 11.4409 11.4409 15.5996 15.5996 15.7162 15.7162 18.4900 18.4900 k = 0.0321 0.0168 0.0512 ( 522 PWs) bands (ev): -12.6030 -12.6030 0.5134 0.5134 3.9914 3.9914 4.0323 4.0323 11.4222 11.4222 15.5886 15.5886 15.6742 15.6742 18.5304 18.5304 k = 0.0256 0.0134 0.0410 ( 522 PWs) bands (ev): -12.6122 -12.6122 0.5055 0.5055 4.0249 4.0249 4.0539 4.0539 11.4069 11.4069 15.5753 15.5753 15.6436 15.6436 18.5635 18.5635 k = 0.0192 0.0101 0.0307 ( 524 PWs) bands (ev): -12.6193 -12.6193 0.4994 0.4994 4.0489 4.0489 4.0728 4.0728 11.3949 11.3949 15.5602 15.5602 15.6243 15.6243 18.5894 18.5894 k = 0.0128 0.0067 0.0205 ( 525 PWs) bands (ev): -12.6243 -12.6243 0.4950 0.4950 4.0643 4.0643 4.0883 4.0883 11.3864 11.3864 15.5463 15.5463 15.6135 15.6135 18.6079 18.6079 k = 0.0064 0.0034 0.0102 ( 525 PWs) bands (ev): -12.6274 -12.6274 0.4924 0.4924 4.0727 4.0727 4.0985 4.0985 11.3813 11.3813 15.5368 15.5368 15.6081 15.6081 18.6190 18.6190 k = 0.0000 0.0000 0.0000 ( 525 PWs) bands (ev): -12.6284 -12.6284 0.4915 0.4915 4.0754 4.0754 4.1020 4.1020 11.3796 11.3796 15.5335 15.5335 15.6065 15.6065 18.6227 18.6227 Writing output data file C.save init_run : 0.36s CPU 0.55s WALL ( 1 calls) electrons : 27.53s CPU 29.61s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.01s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 27.52s CPU 29.60s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.00s CPU 0.00s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.01s WALL ( 725 calls) cegterg : 24.98s CPU 25.75s WALL ( 725 calls) Called by sum_band: Called by *egterg: h_psi : 11.38s CPU 12.07s WALL ( 8427 calls) s_psi : 0.15s CPU 0.16s WALL ( 8427 calls) g_psi : 0.02s CPU 0.02s WALL ( 6977 calls) cdiaghg : 13.42s CPU 13.46s WALL ( 7702 calls) cegterg:over : 0.70s CPU 0.75s WALL ( 6977 calls) cegterg:upda : 0.57s CPU 0.54s WALL ( 6977 calls) cegterg:last : 0.29s CPU 0.28s WALL ( 1692 calls) cdiaghg:chol : 0.84s CPU 0.76s WALL ( 7702 calls) cdiaghg:inve : 0.18s CPU 0.17s WALL ( 7702 calls) cdiaghg:para : 1.05s CPU 0.98s WALL ( 15404 calls) Called by h_psi: h_psi:vloc : 10.79s CPU 11.43s WALL ( 8427 calls) h_psi:vnl : 0.56s CPU 0.62s WALL ( 8427 calls) add_vuspsi : 0.17s CPU 0.21s WALL ( 8427 calls) General routines calbec : 0.36s CPU 0.39s WALL ( 8427 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 10.10s CPU 10.72s WALL ( 355872 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.12s CPU 0.22s WALL ( 1450 calls) Parallel routines fft_scatter : 5.64s CPU 5.99s WALL ( 355895 calls) PWSCF : 0m36.91s CPU 1m43.89s WALL This run was terminated on: 17:15: 8 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=