Program PWSCF v.5.3.0 (svn rev. 11974) starts on 30Nov2016 at 6:46:13 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 64 processors R & G space division: proc/nbgrp/npool/nimage = 64 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: ./CrWN2.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 25 21 6 473 370 59 Max 26 22 7 476 383 62 Sum 1601 1375 399 30367 24121 3865 bravais-lattice index = 14 lattice parameter (alat) = 10.3124 a.u. unit-cell volume = 247.9958 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 38.00 number of Kohn-Sham states= 46 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 374.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.312418 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.863040 celldm(5)= 0.863040 celldm(6)= 0.863040 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.863040 0.505135 0.000000 ) a(3) = ( 0.863040 0.234000 0.447667 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.708532 -1.034794 ) b(2) = ( 0.000000 1.979667 -1.034794 ) b(3) = ( 0.000000 0.000000 2.233804 ) PseudoPot. # 1 for Cr read from file: /home/autes/Pseudo/Cr.rel-pbe-oncvpsp.UPF MD5 check sum: 05b5af6f30ea3763d55f309fcccb1da3 Pseudo is Norm-conserving, Zval = 14.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1638 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 PseudoPot. # 2 for W read from file: /home/autes/Pseudo/W.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 434a31466ac5fb6822520d5f43d3a35f Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1273 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /home/autes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Cr 14.00 51.99610 Cr( 1.00) W 14.00 183.84000 W( 1.00) N 5.00 14.00670 N( 1.00) No symmetry 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 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E Cartesian axes number of k points= 420 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 2) = ( 0.0076923 -0.0131426 -0.0079600), wk = 0.0023810 k( 3) = ( 0.0153846 -0.0262851 -0.0159199), wk = 0.0023810 k( 4) = ( 0.0230769 -0.0394277 -0.0238799), wk = 0.0023810 k( 5) = ( 0.0307692 -0.0525702 -0.0318398), wk = 0.0023810 k( 6) = ( 0.0384615 -0.0657128 -0.0397998), wk = 0.0023810 k( 7) = ( 0.0461539 -0.0788553 -0.0477597), wk = 0.0023810 k( 8) = ( 0.0538462 -0.0919979 -0.0557197), wk = 0.0023810 k( 9) = ( 0.0615385 -0.1051404 -0.0636796), wk = 0.0023810 k( 10) = ( 0.0692308 -0.1182830 -0.0716396), wk = 0.0023810 k( 11) = ( 0.0769231 -0.1314255 -0.0795995), wk = 0.0023810 k( 12) = ( 0.0846154 -0.1445681 -0.0875595), wk = 0.0023810 k( 13) = ( 0.0923077 -0.1577106 -0.0955194), wk = 0.0023810 k( 14) = ( 0.1000000 -0.1708532 -0.1034794), wk = 0.0023810 k( 15) = ( 0.1076923 -0.1839958 -0.1114393), wk = 0.0023810 k( 16) = ( 0.1153846 -0.1971383 -0.1193993), wk = 0.0023810 k( 17) = ( 0.1230769 -0.2102809 -0.1273592), wk = 0.0023810 k( 18) = ( 0.1307692 -0.2234234 -0.1353192), wk = 0.0023810 k( 19) = ( 0.1384615 -0.2365660 -0.1432791), wk = 0.0023810 k( 20) = ( 0.1461539 -0.2497085 -0.1512391), wk = 0.0023810 k( 21) = ( 0.1538461 -0.2628511 -0.1591990), wk = 0.0023810 k( 22) = ( 0.1615385 -0.2759936 -0.1671590), wk = 0.0023810 k( 23) = ( 0.1692308 -0.2891362 -0.1751189), wk = 0.0023810 k( 24) = ( 0.1769231 -0.3022787 -0.1830789), wk = 0.0023810 k( 25) = ( 0.1846154 -0.3154213 -0.1910388), wk = 0.0023810 k( 26) = ( 0.1923077 -0.3285638 -0.1989988), wk = 0.0023810 k( 27) = ( 0.2000000 -0.3417064 -0.2069588), wk = 0.0023810 k( 28) = ( 0.2076923 -0.3548490 -0.2149187), wk = 0.0023810 k( 29) = ( 0.2153846 -0.3679915 -0.2228787), wk = 0.0023810 k( 30) = ( 0.2230769 -0.3811341 -0.2308386), wk = 0.0023810 k( 31) = ( 0.2307692 -0.3942766 -0.2387986), wk = 0.0023810 k( 32) = ( 0.2384615 -0.4074192 -0.2467585), wk = 0.0023810 k( 33) = ( 0.2461539 -0.4205617 -0.2547185), wk = 0.0023810 k( 34) = ( 0.2538461 -0.4337043 -0.2626784), wk = 0.0023810 k( 35) = ( 0.2615385 -0.4468468 -0.2706384), wk = 0.0023810 k( 36) = ( 0.2692308 -0.4599894 -0.2785983), wk = 0.0023810 k( 37) = ( 0.2769231 -0.4731319 -0.2865583), wk = 0.0023810 k( 38) = ( 0.2846154 -0.4862745 -0.2945182), wk = 0.0023810 k( 39) = ( 0.2923077 -0.4994170 -0.3024782), wk = 0.0023810 k( 40) = ( 0.3000000 -0.5125596 -0.3104381), wk = 0.0023810 k( 41) = ( 0.3076923 -0.5257022 -0.3183981), wk = 0.0023810 k( 42) = ( 0.3153846 -0.5388447 -0.3263580), wk = 0.0023810 k( 43) = ( 0.3230769 -0.5519873 -0.3343180), wk = 0.0023810 k( 44) = ( 0.3307692 -0.5651298 -0.3422779), wk = 0.0023810 k( 45) = ( 0.3384615 -0.5782724 -0.3502379), wk = 0.0023810 k( 46) = ( 0.3461538 -0.5914149 -0.3581978), wk = 0.0023810 k( 47) = ( 0.3538462 -0.6045575 -0.3661578), wk = 0.0023810 k( 48) = ( 0.3615385 -0.6177000 -0.3741177), wk = 0.0023810 k( 49) = ( 0.3692308 -0.6308426 -0.3820777), wk = 0.0023810 k( 50) = ( 0.3769231 -0.6439851 -0.3900377), wk = 0.0023810 k( 51) = ( 0.3846154 -0.6571277 -0.3979976), wk = 0.0023810 k( 52) = ( 0.3923077 -0.6702702 -0.4059576), wk = 0.0023810 k( 53) = ( 0.4000000 -0.6834128 -0.4139175), wk = 0.0023810 k( 54) = ( 0.4076923 -0.6965554 -0.4218775), wk = 0.0023810 k( 55) = ( 0.4153846 -0.7096979 -0.4298374), wk = 0.0023810 k( 56) = ( 0.4230769 -0.7228405 -0.4377974), wk = 0.0023810 k( 57) = ( 0.4307692 -0.7359830 -0.4457573), wk = 0.0023810 k( 58) = ( 0.4384615 -0.7491256 -0.4537173), wk = 0.0023810 k( 59) = ( 0.4461539 -0.7622681 -0.4616772), wk = 0.0023810 k( 60) = ( 0.4538462 -0.7754107 -0.4696372), wk = 0.0023810 k( 61) = ( 0.4615385 -0.7885532 -0.4775971), wk = 0.0023810 k( 62) = ( 0.4692308 -0.8016958 -0.4855571), wk = 0.0023810 k( 63) = ( 0.4769231 -0.8148383 -0.4935170), wk = 0.0023810 k( 64) = ( 0.4846154 -0.8279809 -0.5014770), wk = 0.0023810 k( 65) = ( 0.4923077 -0.8411234 -0.5094369), wk = 0.0023810 k( 66) = ( 0.5000000 -0.8542660 -0.5173969), wk = 0.0023810 k( 67) = ( 0.5000000 -0.8542660 -0.5173969), wk = 0.0023810 k( 68) = ( 0.5000000 -0.8454100 -0.5320190), wk = 0.0023810 k( 69) = ( 0.5000000 -0.8365539 -0.5466410), wk = 0.0023810 k( 70) = ( 0.5000000 -0.8276979 -0.5612631), wk = 0.0023810 k( 71) = ( 0.5000000 -0.8188418 -0.5758852), wk = 0.0023810 k( 72) = ( 0.5000000 -0.8099858 -0.5905072), wk = 0.0023810 k( 73) = ( 0.5000000 -0.8011297 -0.6051294), wk = 0.0023810 k( 74) = ( 0.5000000 -0.7922737 -0.6197514), wk = 0.0023810 k( 75) = ( 0.5000000 -0.7834177 -0.6343735), wk = 0.0023810 k( 76) = ( 0.5000000 -0.7745616 -0.6489956), wk = 0.0023810 k( 77) = ( 0.5000000 -0.7657056 -0.6636176), wk = 0.0023810 k( 78) = ( 0.5000000 -0.7568495 -0.6782397), wk = 0.0023810 k( 79) = ( 0.5000000 -0.7479935 -0.6928618), wk = 0.0023810 k( 80) = ( 0.5000000 -0.7391375 -0.7074839), wk = 0.0023810 k( 81) = ( 0.5000000 -0.7302814 -0.7221059), wk = 0.0023810 k( 82) = ( 0.5000000 -0.7214254 -0.7367280), wk = 0.0023810 k( 83) = ( 0.5000000 -0.7125693 -0.7513501), wk = 0.0023810 k( 84) = ( 0.5000000 -0.7037133 -0.7659721), wk = 0.0023810 k( 85) = ( 0.5000000 -0.6948572 -0.7805942), wk = 0.0023810 k( 86) = ( 0.5000000 -0.6860012 -0.7952163), wk = 0.0023810 k( 87) = ( 0.5000000 -0.6771452 -0.8098384), wk = 0.0023810 k( 88) = ( 0.5000000 -0.6682891 -0.8244605), wk = 0.0023810 k( 89) = ( 0.5000000 -0.6594331 -0.8390825), wk = 0.0023810 k( 90) = ( 0.5000000 -0.6505770 -0.8537046), wk = 0.0023810 k( 91) = ( 0.5000000 -0.6417210 -0.8683267), wk = 0.0023810 k( 92) = ( 0.5000000 -0.6328649 -0.8829487), wk = 0.0023810 k( 93) = ( 0.5000000 -0.6240089 -0.8975708), wk = 0.0023810 k( 94) = ( 0.5000000 -0.6151529 -0.9121929), wk = 0.0023810 k( 95) = ( 0.5000000 -0.6062968 -0.9268150), wk = 0.0023810 k( 96) = ( 0.5000000 -0.5974408 -0.9414371), wk = 0.0023810 k( 97) = ( 0.5000000 -0.5885847 -0.9560591), wk = 0.0023810 k( 98) = ( 0.5000000 -0.5797287 -0.9706812), wk = 0.0023810 k( 99) = ( 0.5000000 -0.5708726 -0.9853033), wk = 0.0023810 k( 100) = ( 0.5000000 -0.5620166 -0.9999253), wk = 0.0023810 k( 101) = ( 0.5000000 -0.5531606 -1.0145474), wk = 0.0023810 k( 102) = ( 0.5000000 -0.5443045 -1.0291695), wk = 0.0023810 k( 103) = ( 0.5000000 -0.5354485 -1.0437916), wk = 0.0023810 k( 104) = ( 0.5000000 -0.5265924 -1.0584136), wk = 0.0023810 k( 105) = ( 0.5000000 -0.5177364 -1.0730357), wk = 0.0023810 k( 106) = ( 0.5000000 -0.5088804 -1.0876578), wk = 0.0023810 k( 107) = ( 0.5000000 -0.5000243 -1.1022799), wk = 0.0023810 k( 108) = ( 0.5000000 -0.4911683 -1.1169020), wk = 0.0023810 k( 109) = ( 0.8165865 -0.4053306 -0.9526856), wk = 0.0023810 k( 110) = ( 0.8120638 -0.3976035 -0.9379028), wk = 0.0023810 k( 111) = ( 0.8075411 -0.3898764 -0.9231201), wk = 0.0023810 k( 112) = ( 0.8030185 -0.3821492 -0.9083373), wk = 0.0023810 k( 113) = ( 0.7984958 -0.3744221 -0.8935545), wk = 0.0023810 k( 114) = ( 0.7939732 -0.3666950 -0.8787718), wk = 0.0023810 k( 115) = ( 0.7894505 -0.3589679 -0.8639890), wk = 0.0023810 k( 116) = ( 0.7849278 -0.3512408 -0.8492062), wk = 0.0023810 k( 117) = ( 0.7804051 -0.3435137 -0.8344235), wk = 0.0023810 k( 118) = ( 0.7758825 -0.3357865 -0.8196407), wk = 0.0023810 k( 119) = ( 0.7713598 -0.3280594 -0.8048579), wk = 0.0023810 k( 120) = ( 0.7668372 -0.3203323 -0.7900752), wk = 0.0023810 k( 121) = ( 0.7623145 -0.3126052 -0.7752924), wk = 0.0023810 k( 122) = ( 0.7577918 -0.3048781 -0.7605096), wk = 0.0023810 k( 123) = ( 0.7532692 -0.2971510 -0.7457269), wk = 0.0023810 k( 124) = ( 0.7487465 -0.2894239 -0.7309441), wk = 0.0023810 k( 125) = ( 0.7442238 -0.2816967 -0.7161613), wk = 0.0023810 k( 126) = ( 0.7397012 -0.2739696 -0.7013786), wk = 0.0023810 k( 127) = ( 0.7351785 -0.2662425 -0.6865958), wk = 0.0023810 k( 128) = ( 0.7306558 -0.2585154 -0.6718130), wk = 0.0023810 k( 129) = ( 0.7261332 -0.2507883 -0.6570303), wk = 0.0023810 k( 130) = ( 0.7216105 -0.2430612 -0.6422475), wk = 0.0023810 k( 131) = ( 0.7170879 -0.2353340 -0.6274647), wk = 0.0023810 k( 132) = ( 0.7125652 -0.2276069 -0.6126820), wk = 0.0023810 k( 133) = ( 0.7080425 -0.2198798 -0.5978992), wk = 0.0023810 k( 134) = ( 0.7035199 -0.2121527 -0.5831164), wk = 0.0023810 k( 135) = ( 0.6989972 -0.2044256 -0.5683336), wk = 0.0023810 k( 136) = ( 0.6944745 -0.1966985 -0.5535509), wk = 0.0023810 k( 137) = ( 0.6899519 -0.1889713 -0.5387681), wk = 0.0023810 k( 138) = ( 0.6854292 -0.1812442 -0.5239853), wk = 0.0023810 k( 139) = ( 0.6809065 -0.1735171 -0.5092026), wk = 0.0023810 k( 140) = ( 0.6763839 -0.1657900 -0.4944198), wk = 0.0023810 k( 141) = ( 0.6718612 -0.1580629 -0.4796370), wk = 0.0023810 k( 142) = ( 0.6673386 -0.1503358 -0.4648543), wk = 0.0023810 k( 143) = ( 0.6628159 -0.1426087 -0.4500715), wk = 0.0023810 k( 144) = ( 0.6582932 -0.1348815 -0.4352887), wk = 0.0023810 k( 145) = ( 0.6537706 -0.1271544 -0.4205060), wk = 0.0023810 k( 146) = ( 0.6492479 -0.1194273 -0.4057232), wk = 0.0023810 k( 147) = ( 0.6447252 -0.1117002 -0.3909404), wk = 0.0023810 k( 148) = ( 0.6402026 -0.1039731 -0.3761577), wk = 0.0023810 k( 149) = ( 0.6356799 -0.0962459 -0.3613749), wk = 0.0023810 k( 150) = ( 0.6311573 -0.0885188 -0.3465921), wk = 0.0023810 k( 151) = ( 0.6266346 -0.0807917 -0.3318094), wk = 0.0023810 k( 152) = ( 0.6221119 -0.0730646 -0.3170266), wk = 0.0023810 k( 153) = ( 0.6175893 -0.0653375 -0.3022438), wk = 0.0023810 k( 154) = ( 0.6130666 -0.0576104 -0.2874610), wk = 0.0023810 k( 155) = ( 0.6085439 -0.0498833 -0.2726783), wk = 0.0023810 k( 156) = ( 0.6040213 -0.0421561 -0.2578955), wk = 0.0023810 k( 157) = ( 0.5994986 -0.0344290 -0.2431127), wk = 0.0023810 k( 158) = ( 0.5949759 -0.0267019 -0.2283300), wk = 0.0023810 k( 159) = ( 0.5904533 -0.0189748 -0.2135472), wk = 0.0023810 k( 160) = ( 0.5859306 -0.0112477 -0.1987644), wk = 0.0023810 k( 161) = ( 0.5814080 -0.0035206 -0.1839817), wk = 0.0023810 k( 162) = ( 0.5768853 0.0042066 -0.1691989), wk = 0.0023810 k( 163) = ( 0.5723626 0.0119337 -0.1544161), wk = 0.0023810 k( 164) = ( 0.5678400 0.0196608 -0.1396334), wk = 0.0023810 k( 165) = ( 0.5633173 0.0273879 -0.1248506), wk = 0.0023810 k( 166) = ( 0.5587946 0.0351150 -0.1100678), wk = 0.0023810 k( 167) = ( 0.5542720 0.0428421 -0.0952851), wk = 0.0023810 k( 168) = ( 0.5497493 0.0505692 -0.0805023), wk = 0.0023810 k( 169) = ( 0.5452266 0.0582964 -0.0657195), wk = 0.0023810 k( 170) = ( 0.5407040 0.0660235 -0.0509367), wk = 0.0023810 k( 171) = ( 0.5361813 0.0737506 -0.0361540), wk = 0.0023810 k( 172) = ( 0.5316587 0.0814777 -0.0213712), wk = 0.0023810 k( 173) = ( 0.5271360 0.0892048 -0.0065884), wk = 0.0023810 k( 174) = ( 0.5226133 0.0969319 0.0081943), wk = 0.0023810 k( 175) = ( 0.5180907 0.1046590 0.0229771), wk = 0.0023810 k( 176) = ( 0.5135680 0.1123862 0.0377599), wk = 0.0023810 k( 177) = ( 0.5090453 0.1201133 0.0525426), wk = 0.0023810 k( 178) = ( 0.5045227 0.1278404 0.0673254), wk = 0.0023810 k( 179) = ( 0.5000000 0.1355675 0.0821082), wk = 0.0023810 k( 180) = ( 0.5000000 0.1355675 0.0821082), wk = 0.0023810 k( 181) = ( 0.4838710 0.1311944 0.0794595), wk = 0.0023810 k( 182) = ( 0.4677419 0.1268212 0.0768109), wk = 0.0023810 k( 183) = ( 0.4516129 0.1224481 0.0741622), wk = 0.0023810 k( 184) = ( 0.4354839 0.1180749 0.0715136), wk = 0.0023810 k( 185) = ( 0.4193548 0.1137018 0.0688649), wk = 0.0023810 k( 186) = ( 0.4032258 0.1093286 0.0662163), wk = 0.0023810 k( 187) = ( 0.3870968 0.1049555 0.0635676), wk = 0.0023810 k( 188) = ( 0.3709677 0.1005824 0.0609190), wk = 0.0023810 k( 189) = ( 0.3548387 0.0962092 0.0582703), wk = 0.0023810 k( 190) = ( 0.3387097 0.0918361 0.0556217), wk = 0.0023810 k( 191) = ( 0.3225807 0.0874629 0.0529730), wk = 0.0023810 k( 192) = ( 0.3064516 0.0830898 0.0503244), wk = 0.0023810 k( 193) = ( 0.2903226 0.0787166 0.0476757), wk = 0.0023810 k( 194) = ( 0.2741936 0.0743435 0.0450271), wk = 0.0023810 k( 195) = ( 0.2580645 0.0699703 0.0423784), wk = 0.0023810 k( 196) = ( 0.2419355 0.0655972 0.0397298), wk = 0.0023810 k( 197) = ( 0.2258064 0.0612240 0.0370811), wk = 0.0023810 k( 198) = ( 0.2096774 0.0568509 0.0344325), wk = 0.0023810 k( 199) = ( 0.1935484 0.0524778 0.0317838), wk = 0.0023810 k( 200) = ( 0.1774194 0.0481046 0.0291352), wk = 0.0023810 k( 201) = ( 0.1612903 0.0437315 0.0264865), wk = 0.0023810 k( 202) = ( 0.1451613 0.0393583 0.0238379), wk = 0.0023810 k( 203) = ( 0.1290323 0.0349852 0.0211892), wk = 0.0023810 k( 204) = ( 0.1129032 0.0306120 0.0185406), wk = 0.0023810 k( 205) = ( 0.0967742 0.0262389 0.0158919), wk = 0.0023810 k( 206) = ( 0.0806452 0.0218657 0.0132433), wk = 0.0023810 k( 207) = ( 0.0645161 0.0174926 0.0105946), wk = 0.0023810 k( 208) = ( 0.0483871 0.0131194 0.0079460), wk = 0.0023810 k( 209) = ( 0.0322581 0.0087463 0.0052973), wk = 0.0023810 k( 210) = ( 0.0161290 0.0043731 0.0026487), wk = 0.0023810 k( 211) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 212) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 213) = ( 0.0044961 -0.0076818 -0.0146961), wk = 0.0023810 k( 214) = ( 0.0089923 -0.0153636 -0.0293921), wk = 0.0023810 k( 215) = ( 0.0134884 -0.0230454 -0.0440883), wk = 0.0023810 k( 216) = ( 0.0179846 -0.0307272 -0.0587843), wk = 0.0023810 k( 217) = ( 0.0224807 -0.0384090 -0.0734804), wk = 0.0023810 k( 218) = ( 0.0269769 -0.0460908 -0.0881765), wk = 0.0023810 k( 219) = ( 0.0314730 -0.0537726 -0.1028725), wk = 0.0023810 k( 220) = ( 0.0359691 -0.0614544 -0.1175686), wk = 0.0023810 k( 221) = ( 0.0404653 -0.0691362 -0.1322647), wk = 0.0023810 k( 222) = ( 0.0449614 -0.0768180 -0.1469608), wk = 0.0023810 k( 223) = ( 0.0494576 -0.0844998 -0.1616569), wk = 0.0023810 k( 224) = ( 0.0539537 -0.0921816 -0.1763529), wk = 0.0023810 k( 225) = ( 0.0584498 -0.0998634 -0.1910490), wk = 0.0023810 k( 226) = ( 0.0629460 -0.1075452 -0.2057451), wk = 0.0023810 k( 227) = ( 0.0674421 -0.1152270 -0.2204412), wk = 0.0023810 k( 228) = ( 0.0719383 -0.1229088 -0.2351373), wk = 0.0023810 k( 229) = ( 0.0764344 -0.1305906 -0.2498333), wk = 0.0023810 k( 230) = ( 0.0809306 -0.1382724 -0.2645294), wk = 0.0023810 k( 231) = ( 0.0854267 -0.1459542 -0.2792255), wk = 0.0023810 k( 232) = ( 0.0899228 -0.1536360 -0.2939216), wk = 0.0023810 k( 233) = ( 0.0944190 -0.1613178 -0.3086177), wk = 0.0023810 k( 234) = ( 0.0989151 -0.1689996 -0.3233137), wk = 0.0023810 k( 235) = ( 0.1034113 -0.1766814 -0.3380098), wk = 0.0023810 k( 236) = ( 0.1079074 -0.1843632 -0.3527059), wk = 0.0023810 k( 237) = ( 0.1124035 -0.1920450 -0.3674019), wk = 0.0023810 k( 238) = ( 0.1168997 -0.1997268 -0.3820980), wk = 0.0023810 k( 239) = ( 0.1213958 -0.2074087 -0.3967941), wk = 0.0023810 k( 240) = ( 0.1258920 -0.2150905 -0.4114902), wk = 0.0023810 k( 241) = ( 0.1303881 -0.2227723 -0.4261863), wk = 0.0023810 k( 242) = ( 0.1348843 -0.2304541 -0.4408823), wk = 0.0023810 k( 243) = ( 0.1393804 -0.2381359 -0.4555784), wk = 0.0023810 k( 244) = ( 0.1438765 -0.2458177 -0.4702745), wk = 0.0023810 k( 245) = ( 0.1483727 -0.2534995 -0.4849706), wk = 0.0023810 k( 246) = ( 0.1528688 -0.2611813 -0.4996667), wk = 0.0023810 k( 247) = ( 0.1573650 -0.2688631 -0.5143627), wk = 0.0023810 k( 248) = ( 0.1618611 -0.2765449 -0.5290588), wk = 0.0023810 k( 249) = ( 0.1663572 -0.2842267 -0.5437549), wk = 0.0023810 k( 250) = ( 0.1708534 -0.2919085 -0.5584510), wk = 0.0023810 k( 251) = ( 0.1753495 -0.2995903 -0.5731471), wk = 0.0023810 k( 252) = ( 0.1798457 -0.3072721 -0.5878431), wk = 0.0023810 k( 253) = ( 0.1843418 -0.3149539 -0.6025392), wk = 0.0023810 k( 254) = ( 0.1888380 -0.3226357 -0.6172353), wk = 0.0023810 k( 255) = ( 0.1933341 -0.3303175 -0.6319314), wk = 0.0023810 k( 256) = ( 0.1978302 -0.3379993 -0.6466274), wk = 0.0023810 k( 257) = ( 0.2023264 -0.3456811 -0.6613235), wk = 0.0023810 k( 258) = ( 0.2068225 -0.3533629 -0.6760196), wk = 0.0023810 k( 259) = ( 0.2113187 -0.3610447 -0.6907157), wk = 0.0023810 k( 260) = ( 0.2158148 -0.3687265 -0.7054117), wk = 0.0023810 k( 261) = ( 0.2203109 -0.3764083 -0.7201078), wk = 0.0023810 k( 262) = ( 0.2248071 -0.3840901 -0.7348039), wk = 0.0023810 k( 263) = ( 0.2293032 -0.3917719 -0.7495000), wk = 0.0023810 k( 264) = ( 0.2337994 -0.3994537 -0.7641961), wk = 0.0023810 k( 265) = ( 0.2382955 -0.4071355 -0.7788921), wk = 0.0023810 k( 266) = ( 0.2427916 -0.4148173 -0.7935882), wk = 0.0023810 k( 267) = ( 0.2472878 -0.4224991 -0.8082843), wk = 0.0023810 k( 268) = ( 0.2517839 -0.4301809 -0.8229804), wk = 0.0023810 k( 269) = ( 0.2562801 -0.4378627 -0.8376765), wk = 0.0023810 k( 270) = ( 0.2607762 -0.4455445 -0.8523725), wk = 0.0023810 k( 271) = ( 0.2652724 -0.4532263 -0.8670686), wk = 0.0023810 k( 272) = ( 0.2697685 -0.4609081 -0.8817647), wk = 0.0023810 k( 273) = ( 0.2742646 -0.4685899 -0.8964608), wk = 0.0023810 k( 274) = ( 0.2787608 -0.4762717 -0.9111568), wk = 0.0023810 k( 275) = ( 0.2832569 -0.4839535 -0.9258529), wk = 0.0023810 k( 276) = ( 0.2877531 -0.4916353 -0.9405490), wk = 0.0023810 k( 277) = ( 0.2922492 -0.4993171 -0.9552451), wk = 0.0023810 k( 278) = ( 0.2967454 -0.5069989 -0.9699412), wk = 0.0023810 k( 279) = ( 0.3012415 -0.5146807 -0.9846372), wk = 0.0023810 k( 280) = ( 0.3057376 -0.5223625 -0.9993333), wk = 0.0023810 k( 281) = ( 0.3102338 -0.5300443 -1.0140294), wk = 0.0023810 k( 282) = ( 0.3147299 -0.5377261 -1.0287255), wk = 0.0023810 k( 283) = ( 0.3192261 -0.5454079 -1.0434216), wk = 0.0023810 k( 284) = ( 0.3237222 -0.5530897 -1.0581176), wk = 0.0023810 k( 285) = ( 0.3282183 -0.5607715 -1.0728137), wk = 0.0023810 k( 286) = ( 0.3327145 -0.5684533 -1.0875098), wk = 0.0023810 k( 287) = ( 0.3372106 -0.5761352 -1.1022059), wk = 0.0023810 k( 288) = ( 0.3417068 -0.5838170 -1.1169019), wk = 0.0023810 k( 289) = ( 0.6582932 -0.4482494 -1.0347938), wk = 0.0023810 k( 290) = ( 0.6537706 -0.4315690 -1.0347938), wk = 0.0023810 k( 291) = ( 0.6492479 -0.4148884 -1.0347938), wk = 0.0023810 k( 292) = ( 0.6447252 -0.3982080 -1.0347938), wk = 0.0023810 k( 293) = ( 0.6402026 -0.3815275 -1.0347938), wk = 0.0023810 k( 294) = ( 0.6356799 -0.3648470 -1.0347938), wk = 0.0023810 k( 295) = ( 0.6311573 -0.3481665 -1.0347938), wk = 0.0023810 k( 296) = ( 0.6266346 -0.3314861 -1.0347938), wk = 0.0023810 k( 297) = ( 0.6221119 -0.3148055 -1.0347938), wk = 0.0023810 k( 298) = ( 0.6175893 -0.2981251 -1.0347938), wk = 0.0023810 k( 299) = ( 0.6130666 -0.2814446 -1.0347938), wk = 0.0023810 k( 300) = ( 0.6085439 -0.2647641 -1.0347938), wk = 0.0023810 k( 301) = ( 0.6040213 -0.2480836 -1.0347938), wk = 0.0023810 k( 302) = ( 0.5994986 -0.2314031 -1.0347938), wk = 0.0023810 k( 303) = ( 0.5949759 -0.2147227 -1.0347938), wk = 0.0023810 k( 304) = ( 0.5904533 -0.1980422 -1.0347938), wk = 0.0023810 k( 305) = ( 0.5859306 -0.1813617 -1.0347938), wk = 0.0023810 k( 306) = ( 0.5814080 -0.1646812 -1.0347938), wk = 0.0023810 k( 307) = ( 0.5768853 -0.1480007 -1.0347938), wk = 0.0023810 k( 308) = ( 0.5723626 -0.1313202 -1.0347938), wk = 0.0023810 k( 309) = ( 0.5678400 -0.1146398 -1.0347938), wk = 0.0023810 k( 310) = ( 0.5633173 -0.0979592 -1.0347938), wk = 0.0023810 k( 311) = ( 0.5587946 -0.0812788 -1.0347938), wk = 0.0023810 k( 312) = ( 0.5542720 -0.0645983 -1.0347938), wk = 0.0023810 k( 313) = ( 0.5497493 -0.0479178 -1.0347938), wk = 0.0023810 k( 314) = ( 0.5452266 -0.0312373 -1.0347938), wk = 0.0023810 k( 315) = ( 0.5407040 -0.0145568 -1.0347938), wk = 0.0023810 k( 316) = ( 0.5361813 0.0021236 -1.0347938), wk = 0.0023810 k( 317) = ( 0.5316587 0.0188041 -1.0347938), wk = 0.0023810 k( 318) = ( 0.5271360 0.0354846 -1.0347938), wk = 0.0023810 k( 319) = ( 0.5226133 0.0521651 -1.0347938), wk = 0.0023810 k( 320) = ( 0.5180907 0.0688456 -1.0347938), wk = 0.0023810 k( 321) = ( 0.5135680 0.0855261 -1.0347938), wk = 0.0023810 k( 322) = ( 0.5090453 0.1022065 -1.0347938), wk = 0.0023810 k( 323) = ( 0.5045227 0.1188871 -1.0347938), wk = 0.0023810 k( 324) = ( 0.5000000 0.1355675 -1.0347938), wk = 0.0023810 k( 325) = ( 0.5000000 0.1355675 -1.0347938), wk = 0.0023810 k( 326) = ( 0.5143903 0.1394692 -1.0273294), wk = 0.0023810 k( 327) = ( 0.5287806 0.1433709 -1.0198650), wk = 0.0023810 k( 328) = ( 0.5431709 0.1472727 -1.0124006), wk = 0.0023810 k( 329) = ( 0.5575612 0.1511744 -1.0049363), wk = 0.0023810 k( 330) = ( 0.5719515 0.1550761 -0.9974719), wk = 0.0023810 k( 331) = ( 0.5863418 0.1589778 -0.9900075), wk = 0.0023810 k( 332) = ( 0.6007321 0.1628795 -0.9825431), wk = 0.0023810 k( 333) = ( 0.6151224 0.1667812 -0.9750788), wk = 0.0023810 k( 334) = ( 0.6295126 0.1706829 -0.9676144), wk = 0.0023810 k( 335) = ( 0.6439029 0.1745846 -0.9601500), wk = 0.0023810 k( 336) = ( 0.6582932 0.1784864 -0.9526856), wk = 0.0023810 k( 337) = ( 0.6582932 0.1784864 -0.9526856), wk = 0.0023810 k( 338) = ( 0.6556983 0.1777828 -0.9357218), wk = 0.0023810 k( 339) = ( 0.6531033 0.1770792 -0.9187579), wk = 0.0023810 k( 340) = ( 0.6505083 0.1763756 -0.9017941), wk = 0.0023810 k( 341) = ( 0.6479134 0.1756720 -0.8848303), wk = 0.0023810 k( 342) = ( 0.6453184 0.1749684 -0.8678664), wk = 0.0023810 k( 343) = ( 0.6427234 0.1742648 -0.8509026), wk = 0.0023810 k( 344) = ( 0.6401284 0.1735613 -0.8339388), wk = 0.0023810 k( 345) = ( 0.6375335 0.1728577 -0.8169749), wk = 0.0023810 k( 346) = ( 0.6349385 0.1721541 -0.8000111), wk = 0.0023810 k( 347) = ( 0.6323435 0.1714505 -0.7830473), wk = 0.0023810 k( 348) = ( 0.6297485 0.1707469 -0.7660834), wk = 0.0023810 k( 349) = ( 0.6271536 0.1700433 -0.7491196), wk = 0.0023810 k( 350) = ( 0.6245586 0.1693397 -0.7321558), wk = 0.0023810 k( 351) = ( 0.6219636 0.1686361 -0.7151920), wk = 0.0023810 k( 352) = ( 0.6193687 0.1679325 -0.6982281), wk = 0.0023810 k( 353) = ( 0.6167737 0.1672290 -0.6812643), wk = 0.0023810 k( 354) = ( 0.6141787 0.1665254 -0.6643005), wk = 0.0023810 k( 355) = ( 0.6115837 0.1658218 -0.6473366), wk = 0.0023810 k( 356) = ( 0.6089888 0.1651182 -0.6303728), wk = 0.0023810 k( 357) = ( 0.6063938 0.1644146 -0.6134090), wk = 0.0023810 k( 358) = ( 0.6037988 0.1637110 -0.5964451), wk = 0.0023810 k( 359) = ( 0.6012039 0.1630074 -0.5794813), wk = 0.0023810 k( 360) = ( 0.5986089 0.1623038 -0.5625175), wk = 0.0023810 k( 361) = ( 0.5960139 0.1616003 -0.5455536), wk = 0.0023810 k( 362) = ( 0.5934190 0.1608967 -0.5285898), wk = 0.0023810 k( 363) = ( 0.5908240 0.1601931 -0.5116260), wk = 0.0023810 k( 364) = ( 0.5882290 0.1594895 -0.4946621), wk = 0.0023810 k( 365) = ( 0.5856340 0.1587859 -0.4776983), wk = 0.0023810 k( 366) = ( 0.5830391 0.1580823 -0.4607345), wk = 0.0023810 k( 367) = ( 0.5804441 0.1573787 -0.4437706), wk = 0.0023810 k( 368) = ( 0.5778491 0.1566751 -0.4268068), wk = 0.0023810 k( 369) = ( 0.5752542 0.1559716 -0.4098430), wk = 0.0023810 k( 370) = ( 0.5726592 0.1552680 -0.3928792), wk = 0.0023810 k( 371) = ( 0.5700642 0.1545644 -0.3759153), wk = 0.0023810 k( 372) = ( 0.5674693 0.1538608 -0.3589515), wk = 0.0023810 k( 373) = ( 0.5648743 0.1531572 -0.3419877), wk = 0.0023810 k( 374) = ( 0.5622793 0.1524536 -0.3250238), wk = 0.0023810 k( 375) = ( 0.5596843 0.1517500 -0.3080600), wk = 0.0023810 k( 376) = ( 0.5570894 0.1510464 -0.2910961), wk = 0.0023810 k( 377) = ( 0.5544944 0.1503429 -0.2741323), wk = 0.0023810 k( 378) = ( 0.5518994 0.1496393 -0.2571685), wk = 0.0023810 k( 379) = ( 0.5493045 0.1489357 -0.2402047), wk = 0.0023810 k( 380) = ( 0.5467095 0.1482321 -0.2232408), wk = 0.0023810 k( 381) = ( 0.5441145 0.1475285 -0.2062770), wk = 0.0023810 k( 382) = ( 0.5415195 0.1468249 -0.1893132), wk = 0.0023810 k( 383) = ( 0.5389246 0.1461213 -0.1723493), wk = 0.0023810 k( 384) = ( 0.5363296 0.1454177 -0.1553855), wk = 0.0023810 k( 385) = ( 0.5337346 0.1447142 -0.1384217), wk = 0.0023810 k( 386) = ( 0.5311396 0.1440106 -0.1214578), wk = 0.0023810 k( 387) = ( 0.5285447 0.1433070 -0.1044940), wk = 0.0023810 k( 388) = ( 0.5259497 0.1426034 -0.0875302), wk = 0.0023810 k( 389) = ( 0.5233547 0.1418998 -0.0705663), wk = 0.0023810 k( 390) = ( 0.5207598 0.1411962 -0.0536025), wk = 0.0023810 k( 391) = ( 0.5181648 0.1404926 -0.0366387), wk = 0.0023810 k( 392) = ( 0.5155698 0.1397890 -0.0196748), wk = 0.0023810 k( 393) = ( 0.5129749 0.1390855 -0.0027110), wk = 0.0023810 k( 394) = ( 0.5103799 0.1383819 0.0142528), wk = 0.0023810 k( 395) = ( 0.5077849 0.1376783 0.0312167), wk = 0.0023810 k( 396) = ( 0.5051899 0.1369747 0.0481805), wk = 0.0023810 k( 397) = ( 0.5025950 0.1362711 0.0651443), wk = 0.0023810 k( 398) = ( 0.5000000 0.1355675 0.0821082), wk = 0.0023810 k( 399) = ( 0.5000000 -0.8542660 -0.5173969), wk = 0.0023810 k( 400) = ( 0.5150756 -0.8478104 -0.5134870), wk = 0.0023810 k( 401) = ( 0.5301511 -0.8413548 -0.5095771), wk = 0.0023810 k( 402) = ( 0.5452266 -0.8348992 -0.5056672), wk = 0.0023810 k( 403) = ( 0.5603022 -0.8284436 -0.5017572), wk = 0.0023810 k( 404) = ( 0.5753777 -0.8219880 -0.4978473), wk = 0.0023810 k( 405) = ( 0.5904533 -0.8155324 -0.4939374), wk = 0.0023810 k( 406) = ( 0.6055288 -0.8090768 -0.4900275), wk = 0.0023810 k( 407) = ( 0.6206044 -0.8026212 -0.4861176), wk = 0.0023810 k( 408) = ( 0.6356799 -0.7961656 -0.4822077), wk = 0.0023810 k( 409) = ( 0.6507555 -0.7897100 -0.4782978), wk = 0.0023810 k( 410) = ( 0.6658310 -0.7832545 -0.4743879), wk = 0.0023810 k( 411) = ( 0.6809065 -0.7767988 -0.4704779), wk = 0.0023810 k( 412) = ( 0.6959821 -0.7703433 -0.4665680), wk = 0.0023810 k( 413) = ( 0.7110576 -0.7638877 -0.4626581), wk = 0.0023810 k( 414) = ( 0.7261332 -0.7574321 -0.4587482), wk = 0.0023810 k( 415) = ( 0.7412087 -0.7509765 -0.4548383), wk = 0.0023810 k( 416) = ( 0.7562843 -0.7445209 -0.4509284), wk = 0.0023810 k( 417) = ( 0.7713598 -0.7380653 -0.4470185), wk = 0.0023810 k( 418) = ( 0.7864354 -0.7316097 -0.4431085), wk = 0.0023810 k( 419) = ( 0.8015109 -0.7251541 -0.4391986), wk = 0.0023810 k( 420) = ( 0.8165865 -0.7186985 -0.4352887), wk = 0.0023810 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 2) = ( 0.0076923 -0.0000000 0.0000000), wk = 0.0023810 k( 3) = ( 0.0153846 -0.0000000 0.0000000), wk = 0.0023810 k( 4) = ( 0.0230769 0.0000000 0.0000000), wk = 0.0023810 k( 5) = ( 0.0307692 -0.0000000 0.0000000), wk = 0.0023810 k( 6) = ( 0.0384615 -0.0000000 -0.0000000), wk = 0.0023810 k( 7) = ( 0.0461539 0.0000000 -0.0000000), wk = 0.0023810 k( 8) = ( 0.0538462 -0.0000000 0.0000000), wk = 0.0023810 k( 9) = ( 0.0615385 -0.0000000 0.0000000), wk = 0.0023810 k( 10) = ( 0.0692308 -0.0000000 0.0000000), wk = 0.0023810 k( 11) = ( 0.0769231 -0.0000000 -0.0000000), wk = 0.0023810 k( 12) = ( 0.0846154 -0.0000000 -0.0000000), wk = 0.0023810 k( 13) = ( 0.0923077 0.0000000 0.0000000), wk = 0.0023810 k( 14) = ( 0.1000000 0.0000000 0.0000000), wk = 0.0023810 k( 15) = ( 0.1076923 -0.0000000 0.0000000), wk = 0.0023810 k( 16) = ( 0.1153846 0.0000000 0.0000000), wk = 0.0023810 k( 17) = ( 0.1230769 -0.0000000 0.0000000), wk = 0.0023810 k( 18) = ( 0.1307692 -0.0000000 -0.0000000), wk = 0.0023810 k( 19) = ( 0.1384615 -0.0000000 0.0000000), wk = 0.0023810 k( 20) = ( 0.1461539 0.0000000 0.0000000), wk = 0.0023810 k( 21) = ( 0.1538461 0.0000000 0.0000000), wk = 0.0023810 k( 22) = ( 0.1615385 -0.0000000 -0.0000000), wk = 0.0023810 k( 23) = ( 0.1692308 -0.0000000 0.0000000), wk = 0.0023810 k( 24) = ( 0.1769231 0.0000000 -0.0000000), wk = 0.0023810 k( 25) = ( 0.1846154 0.0000000 0.0000000), wk = 0.0023810 k( 26) = ( 0.1923077 0.0000000 0.0000000), wk = 0.0023810 k( 27) = ( 0.2000000 0.0000000 0.0000000), wk = 0.0023810 k( 28) = ( 0.2076923 -0.0000000 -0.0000000), wk = 0.0023810 k( 29) = ( 0.2153846 -0.0000000 0.0000000), wk = 0.0023810 k( 30) = ( 0.2230769 0.0000000 0.0000000), wk = 0.0023810 k( 31) = ( 0.2307692 -0.0000000 -0.0000000), wk = 0.0023810 k( 32) = ( 0.2384615 0.0000000 0.0000000), wk = 0.0023810 k( 33) = ( 0.2461539 -0.0000000 -0.0000000), wk = 0.0023810 k( 34) = ( 0.2538461 0.0000000 0.0000000), wk = 0.0023810 k( 35) = ( 0.2615385 -0.0000000 -0.0000000), wk = 0.0023810 k( 36) = ( 0.2692308 -0.0000000 -0.0000000), wk = 0.0023810 k( 37) = ( 0.2769231 -0.0000000 0.0000000), wk = 0.0023810 k( 38) = ( 0.2846154 -0.0000000 -0.0000000), wk = 0.0023810 k( 39) = ( 0.2923077 -0.0000000 0.0000000), wk = 0.0023810 k( 40) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0023810 k( 41) = ( 0.3076923 0.0000000 -0.0000000), wk = 0.0023810 k( 42) = ( 0.3153846 0.0000000 0.0000000), wk = 0.0023810 k( 43) = ( 0.3230769 -0.0000000 -0.0000000), wk = 0.0023810 k( 44) = ( 0.3307692 -0.0000000 0.0000000), wk = 0.0023810 k( 45) = ( 0.3384615 -0.0000000 0.0000000), wk = 0.0023810 k( 46) = ( 0.3461538 -0.0000000 0.0000000), wk = 0.0023810 k( 47) = ( 0.3538462 0.0000000 0.0000000), wk = 0.0023810 k( 48) = ( 0.3615385 0.0000000 0.0000000), wk = 0.0023810 k( 49) = ( 0.3692308 0.0000000 0.0000000), wk = 0.0023810 k( 50) = ( 0.3769231 -0.0000000 0.0000000), wk = 0.0023810 k( 51) = ( 0.3846154 0.0000000 0.0000000), wk = 0.0023810 k( 52) = ( 0.3923077 0.0000000 0.0000000), wk = 0.0023810 k( 53) = ( 0.4000000 0.0000000 0.0000000), wk = 0.0023810 k( 54) = ( 0.4076923 -0.0000000 -0.0000000), wk = 0.0023810 k( 55) = ( 0.4153846 -0.0000000 -0.0000000), wk = 0.0023810 k( 56) = ( 0.4230769 0.0000000 0.0000000), wk = 0.0023810 k( 57) = ( 0.4307692 -0.0000000 -0.0000000), wk = 0.0023810 k( 58) = ( 0.4384615 -0.0000000 -0.0000000), wk = 0.0023810 k( 59) = ( 0.4461539 0.0000000 0.0000000), wk = 0.0023810 k( 60) = ( 0.4538462 0.0000000 0.0000000), wk = 0.0023810 k( 61) = ( 0.4615385 -0.0000000 -0.0000000), wk = 0.0023810 k( 62) = ( 0.4692308 0.0000000 0.0000000), wk = 0.0023810 k( 63) = ( 0.4769231 0.0000000 0.0000000), wk = 0.0023810 k( 64) = ( 0.4846154 0.0000000 0.0000000), wk = 0.0023810 k( 65) = ( 0.4923077 -0.0000000 -0.0000000), wk = 0.0023810 k( 66) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0023810 k( 67) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0023810 k( 68) = ( 0.5000000 0.0044735 -0.0044735), wk = 0.0023810 k( 69) = ( 0.5000000 0.0089470 -0.0089470), wk = 0.0023810 k( 70) = ( 0.5000000 0.0134205 -0.0134205), wk = 0.0023810 k( 71) = ( 0.5000000 0.0178940 -0.0178940), wk = 0.0023810 k( 72) = ( 0.5000000 0.0223675 -0.0223675), wk = 0.0023810 k( 73) = ( 0.5000000 0.0268410 -0.0268410), wk = 0.0023810 k( 74) = ( 0.5000000 0.0313145 -0.0313145), wk = 0.0023810 k( 75) = ( 0.5000000 0.0357880 -0.0357880), wk = 0.0023810 k( 76) = ( 0.5000000 0.0402615 -0.0402615), wk = 0.0023810 k( 77) = ( 0.5000000 0.0447350 -0.0447350), wk = 0.0023810 k( 78) = ( 0.5000000 0.0492085 -0.0492085), wk = 0.0023810 k( 79) = ( 0.5000000 0.0536820 -0.0536820), wk = 0.0023810 k( 80) = ( 0.5000000 0.0581555 -0.0581555), wk = 0.0023810 k( 81) = ( 0.5000000 0.0626290 -0.0626290), wk = 0.0023810 k( 82) = ( 0.5000000 0.0671025 -0.0671025), wk = 0.0023810 k( 83) = ( 0.5000000 0.0715760 -0.0715760), wk = 0.0023810 k( 84) = ( 0.5000000 0.0760495 -0.0760495), wk = 0.0023810 k( 85) = ( 0.5000000 0.0805230 -0.0805230), wk = 0.0023810 k( 86) = ( 0.5000000 0.0849965 -0.0849965), wk = 0.0023810 k( 87) = ( 0.5000000 0.0894700 -0.0894700), wk = 0.0023810 k( 88) = ( 0.5000000 0.0939435 -0.0939435), wk = 0.0023810 k( 89) = ( 0.5000000 0.0984170 -0.0984170), wk = 0.0023810 k( 90) = ( 0.5000000 0.1028905 -0.1028905), wk = 0.0023810 k( 91) = ( 0.5000000 0.1073640 -0.1073640), wk = 0.0023810 k( 92) = ( 0.5000000 0.1118375 -0.1118375), wk = 0.0023810 k( 93) = ( 0.5000000 0.1163110 -0.1163110), wk = 0.0023810 k( 94) = ( 0.5000000 0.1207845 -0.1207845), wk = 0.0023810 k( 95) = ( 0.5000000 0.1252580 -0.1252580), wk = 0.0023810 k( 96) = ( 0.5000000 0.1297315 -0.1297315), wk = 0.0023810 k( 97) = ( 0.5000000 0.1342050 -0.1342050), wk = 0.0023810 k( 98) = ( 0.5000000 0.1386785 -0.1386785), wk = 0.0023810 k( 99) = ( 0.5000000 0.1431520 -0.1431520), wk = 0.0023810 k( 100) = ( 0.5000000 0.1476255 -0.1476255), wk = 0.0023810 k( 101) = ( 0.5000000 0.1520990 -0.1520990), wk = 0.0023810 k( 102) = ( 0.5000000 0.1565725 -0.1565725), wk = 0.0023810 k( 103) = ( 0.5000000 0.1610460 -0.1610460), wk = 0.0023810 k( 104) = ( 0.5000000 0.1655195 -0.1655195), wk = 0.0023810 k( 105) = ( 0.5000000 0.1699930 -0.1699930), wk = 0.0023810 k( 106) = ( 0.5000000 0.1744665 -0.1744665), wk = 0.0023810 k( 107) = ( 0.5000000 0.1789400 -0.1789400), wk = 0.0023810 k( 108) = ( 0.5000000 0.1834135 -0.1834135), wk = 0.0023810 k( 109) = ( 0.8165865 0.5000000 0.1834135), wk = 0.0023810 k( 110) = ( 0.8120638 0.5000000 0.1879362), wk = 0.0023810 k( 111) = ( 0.8075411 0.5000000 0.1924589), wk = 0.0023810 k( 112) = ( 0.8030185 0.5000000 0.1969815), wk = 0.0023810 k( 113) = ( 0.7984958 0.5000000 0.2015042), wk = 0.0023810 k( 114) = ( 0.7939732 0.5000000 0.2060269), wk = 0.0023810 k( 115) = ( 0.7894505 0.5000000 0.2105495), wk = 0.0023810 k( 116) = ( 0.7849278 0.5000000 0.2150722), wk = 0.0023810 k( 117) = ( 0.7804051 0.5000000 0.2195949), wk = 0.0023810 k( 118) = ( 0.7758825 0.5000000 0.2241175), wk = 0.0023810 k( 119) = ( 0.7713598 0.5000000 0.2286402), wk = 0.0023810 k( 120) = ( 0.7668372 0.5000000 0.2331628), wk = 0.0023810 k( 121) = ( 0.7623145 0.5000000 0.2376855), wk = 0.0023810 k( 122) = ( 0.7577918 0.5000000 0.2422082), wk = 0.0023810 k( 123) = ( 0.7532692 0.5000000 0.2467308), wk = 0.0023810 k( 124) = ( 0.7487465 0.5000000 0.2512535), wk = 0.0023810 k( 125) = ( 0.7442238 0.5000000 0.2557762), wk = 0.0023810 k( 126) = ( 0.7397012 0.5000000 0.2602988), wk = 0.0023810 k( 127) = ( 0.7351785 0.5000000 0.2648215), wk = 0.0023810 k( 128) = ( 0.7306558 0.5000000 0.2693441), wk = 0.0023810 k( 129) = ( 0.7261332 0.5000000 0.2738668), wk = 0.0023810 k( 130) = ( 0.7216105 0.5000000 0.2783895), wk = 0.0023810 k( 131) = ( 0.7170879 0.5000000 0.2829121), wk = 0.0023810 k( 132) = ( 0.7125652 0.5000000 0.2874348), wk = 0.0023810 k( 133) = ( 0.7080425 0.5000000 0.2919575), wk = 0.0023810 k( 134) = ( 0.7035199 0.5000000 0.2964801), wk = 0.0023810 k( 135) = ( 0.6989972 0.5000000 0.3010028), wk = 0.0023810 k( 136) = ( 0.6944745 0.5000000 0.3055255), wk = 0.0023810 k( 137) = ( 0.6899519 0.5000000 0.3100481), wk = 0.0023810 k( 138) = ( 0.6854292 0.5000000 0.3145708), wk = 0.0023810 k( 139) = ( 0.6809065 0.5000000 0.3190935), wk = 0.0023810 k( 140) = ( 0.6763839 0.5000000 0.3236161), wk = 0.0023810 k( 141) = ( 0.6718612 0.5000000 0.3281388), wk = 0.0023810 k( 142) = ( 0.6673386 0.5000000 0.3326614), wk = 0.0023810 k( 143) = ( 0.6628159 0.5000000 0.3371841), wk = 0.0023810 k( 144) = ( 0.6582932 0.5000000 0.3417068), wk = 0.0023810 k( 145) = ( 0.6537706 0.5000000 0.3462294), wk = 0.0023810 k( 146) = ( 0.6492479 0.5000000 0.3507521), wk = 0.0023810 k( 147) = ( 0.6447252 0.5000000 0.3552748), wk = 0.0023810 k( 148) = ( 0.6402026 0.5000000 0.3597974), wk = 0.0023810 k( 149) = ( 0.6356799 0.5000000 0.3643201), wk = 0.0023810 k( 150) = ( 0.6311573 0.5000000 0.3688427), wk = 0.0023810 k( 151) = ( 0.6266346 0.5000000 0.3733654), wk = 0.0023810 k( 152) = ( 0.6221119 0.5000000 0.3778881), wk = 0.0023810 k( 153) = ( 0.6175893 0.5000000 0.3824107), wk = 0.0023810 k( 154) = ( 0.6130666 0.5000000 0.3869334), wk = 0.0023810 k( 155) = ( 0.6085439 0.5000000 0.3914561), wk = 0.0023810 k( 156) = ( 0.6040213 0.5000000 0.3959787), wk = 0.0023810 k( 157) = ( 0.5994986 0.5000000 0.4005014), wk = 0.0023810 k( 158) = ( 0.5949759 0.5000000 0.4050241), wk = 0.0023810 k( 159) = ( 0.5904533 0.5000000 0.4095467), wk = 0.0023810 k( 160) = ( 0.5859306 0.5000000 0.4140694), wk = 0.0023810 k( 161) = ( 0.5814080 0.5000000 0.4185920), wk = 0.0023810 k( 162) = ( 0.5768853 0.5000000 0.4231147), wk = 0.0023810 k( 163) = ( 0.5723626 0.5000000 0.4276374), wk = 0.0023810 k( 164) = ( 0.5678400 0.5000000 0.4321600), wk = 0.0023810 k( 165) = ( 0.5633173 0.5000000 0.4366827), wk = 0.0023810 k( 166) = ( 0.5587946 0.5000000 0.4412054), wk = 0.0023810 k( 167) = ( 0.5542720 0.5000000 0.4457280), wk = 0.0023810 k( 168) = ( 0.5497493 0.5000000 0.4502507), wk = 0.0023810 k( 169) = ( 0.5452266 0.5000000 0.4547734), wk = 0.0023810 k( 170) = ( 0.5407040 0.5000000 0.4592960), wk = 0.0023810 k( 171) = ( 0.5361813 0.5000000 0.4638187), wk = 0.0023810 k( 172) = ( 0.5316587 0.5000000 0.4683414), wk = 0.0023810 k( 173) = ( 0.5271360 0.5000000 0.4728640), wk = 0.0023810 k( 174) = ( 0.5226133 0.5000000 0.4773867), wk = 0.0023810 k( 175) = ( 0.5180907 0.5000000 0.4819093), wk = 0.0023810 k( 176) = ( 0.5135680 0.5000000 0.4864320), wk = 0.0023810 k( 177) = ( 0.5090453 0.5000000 0.4909547), wk = 0.0023810 k( 178) = ( 0.5045227 0.5000000 0.4954773), wk = 0.0023810 k( 179) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023810 k( 180) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023810 k( 181) = ( 0.4838710 0.4838710 0.4838710), wk = 0.0023810 k( 182) = ( 0.4677419 0.4677419 0.4677419), wk = 0.0023810 k( 183) = ( 0.4516129 0.4516129 0.4516129), wk = 0.0023810 k( 184) = ( 0.4354839 0.4354839 0.4354839), wk = 0.0023810 k( 185) = ( 0.4193548 0.4193548 0.4193548), wk = 0.0023810 k( 186) = ( 0.4032258 0.4032258 0.4032258), wk = 0.0023810 k( 187) = ( 0.3870968 0.3870968 0.3870968), wk = 0.0023810 k( 188) = ( 0.3709677 0.3709677 0.3709677), wk = 0.0023810 k( 189) = ( 0.3548387 0.3548387 0.3548387), wk = 0.0023810 k( 190) = ( 0.3387097 0.3387097 0.3387097), wk = 0.0023810 k( 191) = ( 0.3225807 0.3225807 0.3225807), wk = 0.0023810 k( 192) = ( 0.3064516 0.3064516 0.3064516), wk = 0.0023810 k( 193) = ( 0.2903226 0.2903226 0.2903226), wk = 0.0023810 k( 194) = ( 0.2741936 0.2741936 0.2741935), wk = 0.0023810 k( 195) = ( 0.2580645 0.2580645 0.2580645), wk = 0.0023810 k( 196) = ( 0.2419355 0.2419355 0.2419355), wk = 0.0023810 k( 197) = ( 0.2258064 0.2258064 0.2258064), wk = 0.0023810 k( 198) = ( 0.2096774 0.2096774 0.2096774), wk = 0.0023810 k( 199) = ( 0.1935484 0.1935484 0.1935484), wk = 0.0023810 k( 200) = ( 0.1774194 0.1774194 0.1774194), wk = 0.0023810 k( 201) = ( 0.1612903 0.1612903 0.1612903), wk = 0.0023810 k( 202) = ( 0.1451613 0.1451613 0.1451613), wk = 0.0023810 k( 203) = ( 0.1290323 0.1290323 0.1290323), wk = 0.0023810 k( 204) = ( 0.1129032 0.1129032 0.1129032), wk = 0.0023810 k( 205) = ( 0.0967742 0.0967742 0.0967742), wk = 0.0023810 k( 206) = ( 0.0806452 0.0806452 0.0806452), wk = 0.0023810 k( 207) = ( 0.0645161 0.0645161 0.0645161), wk = 0.0023810 k( 208) = ( 0.0483871 0.0483871 0.0483871), wk = 0.0023810 k( 209) = ( 0.0322581 0.0322581 0.0322581), wk = 0.0023810 k( 210) = ( 0.0161290 0.0161290 0.0161290), wk = 0.0023810 k( 211) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 212) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 213) = ( 0.0044961 -0.0000000 -0.0044961), wk = 0.0023810 k( 214) = ( 0.0089923 -0.0000000 -0.0089923), wk = 0.0023810 k( 215) = ( 0.0134884 0.0000000 -0.0134884), wk = 0.0023810 k( 216) = ( 0.0179846 0.0000000 -0.0179846), wk = 0.0023810 k( 217) = ( 0.0224807 -0.0000000 -0.0224807), wk = 0.0023810 k( 218) = ( 0.0269769 -0.0000000 -0.0269769), wk = 0.0023810 k( 219) = ( 0.0314730 -0.0000000 -0.0314730), wk = 0.0023810 k( 220) = ( 0.0359691 0.0000000 -0.0359691), wk = 0.0023810 k( 221) = ( 0.0404653 0.0000000 -0.0404653), wk = 0.0023810 k( 222) = ( 0.0449614 -0.0000000 -0.0449614), wk = 0.0023810 k( 223) = ( 0.0494576 0.0000000 -0.0494576), wk = 0.0023810 k( 224) = ( 0.0539537 -0.0000000 -0.0539537), wk = 0.0023810 k( 225) = ( 0.0584498 0.0000000 -0.0584498), wk = 0.0023810 k( 226) = ( 0.0629460 -0.0000000 -0.0629460), wk = 0.0023810 k( 227) = ( 0.0674421 -0.0000000 -0.0674421), wk = 0.0023810 k( 228) = ( 0.0719383 -0.0000000 -0.0719383), wk = 0.0023810 k( 229) = ( 0.0764344 0.0000000 -0.0764344), wk = 0.0023810 k( 230) = ( 0.0809306 -0.0000000 -0.0809306), wk = 0.0023810 k( 231) = ( 0.0854267 -0.0000000 -0.0854267), wk = 0.0023810 k( 232) = ( 0.0899228 0.0000000 -0.0899228), wk = 0.0023810 k( 233) = ( 0.0944190 0.0000000 -0.0944190), wk = 0.0023810 k( 234) = ( 0.0989151 0.0000000 -0.0989151), wk = 0.0023810 k( 235) = ( 0.1034113 0.0000000 -0.1034113), wk = 0.0023810 k( 236) = ( 0.1079074 -0.0000000 -0.1079074), wk = 0.0023810 k( 237) = ( 0.1124035 -0.0000000 -0.1124035), wk = 0.0023810 k( 238) = ( 0.1168997 0.0000000 -0.1168997), wk = 0.0023810 k( 239) = ( 0.1213958 -0.0000000 -0.1213958), wk = 0.0023810 k( 240) = ( 0.1258920 -0.0000000 -0.1258920), wk = 0.0023810 k( 241) = ( 0.1303881 -0.0000000 -0.1303881), wk = 0.0023810 k( 242) = ( 0.1348843 -0.0000000 -0.1348843), wk = 0.0023810 k( 243) = ( 0.1393804 0.0000000 -0.1393804), wk = 0.0023810 k( 244) = ( 0.1438765 -0.0000000 -0.1438765), wk = 0.0023810 k( 245) = ( 0.1483727 -0.0000000 -0.1483727), wk = 0.0023810 k( 246) = ( 0.1528688 0.0000000 -0.1528688), wk = 0.0023810 k( 247) = ( 0.1573650 0.0000000 -0.1573650), wk = 0.0023810 k( 248) = ( 0.1618611 -0.0000000 -0.1618611), wk = 0.0023810 k( 249) = ( 0.1663572 0.0000000 -0.1663572), wk = 0.0023810 k( 250) = ( 0.1708534 -0.0000000 -0.1708534), wk = 0.0023810 k( 251) = ( 0.1753495 0.0000000 -0.1753495), wk = 0.0023810 k( 252) = ( 0.1798457 0.0000000 -0.1798457), wk = 0.0023810 k( 253) = ( 0.1843418 -0.0000000 -0.1843418), wk = 0.0023810 k( 254) = ( 0.1888380 0.0000000 -0.1888379), wk = 0.0023810 k( 255) = ( 0.1933341 -0.0000000 -0.1933341), wk = 0.0023810 k( 256) = ( 0.1978302 0.0000000 -0.1978302), wk = 0.0023810 k( 257) = ( 0.2023264 -0.0000000 -0.2023264), wk = 0.0023810 k( 258) = ( 0.2068225 0.0000000 -0.2068225), wk = 0.0023810 k( 259) = ( 0.2113187 0.0000000 -0.2113187), wk = 0.0023810 k( 260) = ( 0.2158148 -0.0000000 -0.2158148), wk = 0.0023810 k( 261) = ( 0.2203109 0.0000000 -0.2203109), wk = 0.0023810 k( 262) = ( 0.2248071 -0.0000000 -0.2248071), wk = 0.0023810 k( 263) = ( 0.2293032 -0.0000000 -0.2293032), wk = 0.0023810 k( 264) = ( 0.2337994 -0.0000000 -0.2337994), wk = 0.0023810 k( 265) = ( 0.2382955 -0.0000000 -0.2382955), wk = 0.0023810 k( 266) = ( 0.2427916 0.0000000 -0.2427916), wk = 0.0023810 k( 267) = ( 0.2472878 0.0000000 -0.2472878), wk = 0.0023810 k( 268) = ( 0.2517839 -0.0000000 -0.2517839), wk = 0.0023810 k( 269) = ( 0.2562801 0.0000000 -0.2562801), wk = 0.0023810 k( 270) = ( 0.2607762 -0.0000000 -0.2607762), wk = 0.0023810 k( 271) = ( 0.2652724 0.0000000 -0.2652724), wk = 0.0023810 k( 272) = ( 0.2697685 -0.0000000 -0.2697685), wk = 0.0023810 k( 273) = ( 0.2742646 -0.0000000 -0.2742646), wk = 0.0023810 k( 274) = ( 0.2787608 0.0000000 -0.2787608), wk = 0.0023810 k( 275) = ( 0.2832569 -0.0000000 -0.2832569), wk = 0.0023810 k( 276) = ( 0.2877531 0.0000000 -0.2877531), wk = 0.0023810 k( 277) = ( 0.2922492 -0.0000000 -0.2922492), wk = 0.0023810 k( 278) = ( 0.2967454 0.0000000 -0.2967454), wk = 0.0023810 k( 279) = ( 0.3012415 -0.0000000 -0.3012415), wk = 0.0023810 k( 280) = ( 0.3057376 0.0000000 -0.3057376), wk = 0.0023810 k( 281) = ( 0.3102338 0.0000000 -0.3102338), wk = 0.0023810 k( 282) = ( 0.3147299 0.0000000 -0.3147299), wk = 0.0023810 k( 283) = ( 0.3192261 -0.0000000 -0.3192261), wk = 0.0023810 k( 284) = ( 0.3237222 -0.0000000 -0.3237222), wk = 0.0023810 k( 285) = ( 0.3282183 0.0000000 -0.3282183), wk = 0.0023810 k( 286) = ( 0.3327145 0.0000000 -0.3327145), wk = 0.0023810 k( 287) = ( 0.3372106 0.0000000 -0.3372106), wk = 0.0023810 k( 288) = ( 0.3417068 -0.0000000 -0.3417068), wk = 0.0023810 k( 289) = ( 0.6582932 0.3417068 0.0000000), wk = 0.0023810 k( 290) = ( 0.6537706 0.3462294 0.0000000), wk = 0.0023810 k( 291) = ( 0.6492479 0.3507521 0.0000000), wk = 0.0023810 k( 292) = ( 0.6447252 0.3552748 0.0000000), wk = 0.0023810 k( 293) = ( 0.6402026 0.3597974 0.0000000), wk = 0.0023810 k( 294) = ( 0.6356799 0.3643201 -0.0000000), wk = 0.0023810 k( 295) = ( 0.6311573 0.3688427 0.0000000), wk = 0.0023810 k( 296) = ( 0.6266346 0.3733654 -0.0000000), wk = 0.0023810 k( 297) = ( 0.6221119 0.3778881 0.0000000), wk = 0.0023810 k( 298) = ( 0.6175893 0.3824107 0.0000000), wk = 0.0023810 k( 299) = ( 0.6130666 0.3869334 -0.0000000), wk = 0.0023810 k( 300) = ( 0.6085439 0.3914561 -0.0000000), wk = 0.0023810 k( 301) = ( 0.6040213 0.3959787 0.0000000), wk = 0.0023810 k( 302) = ( 0.5994986 0.4005014 -0.0000000), wk = 0.0023810 k( 303) = ( 0.5949759 0.4050241 -0.0000000), wk = 0.0023810 k( 304) = ( 0.5904533 0.4095467 -0.0000000), wk = 0.0023810 k( 305) = ( 0.5859306 0.4140694 -0.0000000), wk = 0.0023810 k( 306) = ( 0.5814080 0.4185920 -0.0000000), wk = 0.0023810 k( 307) = ( 0.5768853 0.4231147 0.0000000), wk = 0.0023810 k( 308) = ( 0.5723626 0.4276374 0.0000000), wk = 0.0023810 k( 309) = ( 0.5678400 0.4321600 0.0000000), wk = 0.0023810 k( 310) = ( 0.5633173 0.4366827 -0.0000000), wk = 0.0023810 k( 311) = ( 0.5587946 0.4412054 -0.0000000), wk = 0.0023810 k( 312) = ( 0.5542720 0.4457280 0.0000000), wk = 0.0023810 k( 313) = ( 0.5497493 0.4502507 0.0000000), wk = 0.0023810 k( 314) = ( 0.5452266 0.4547734 -0.0000000), wk = 0.0023810 k( 315) = ( 0.5407040 0.4592960 0.0000000), wk = 0.0023810 k( 316) = ( 0.5361813 0.4638187 0.0000000), wk = 0.0023810 k( 317) = ( 0.5316587 0.4683413 -0.0000000), wk = 0.0023810 k( 318) = ( 0.5271360 0.4728640 0.0000000), wk = 0.0023810 k( 319) = ( 0.5226133 0.4773867 0.0000000), wk = 0.0023810 k( 320) = ( 0.5180907 0.4819093 0.0000000), wk = 0.0023810 k( 321) = ( 0.5135680 0.4864320 0.0000000), wk = 0.0023810 k( 322) = ( 0.5090453 0.4909547 -0.0000000), wk = 0.0023810 k( 323) = ( 0.5045227 0.4954773 0.0000000), wk = 0.0023810 k( 324) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0023810 k( 325) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0023810 k( 326) = ( 0.5143903 0.5143903 0.0166740), wk = 0.0023810 k( 327) = ( 0.5287806 0.5287806 0.0333479), wk = 0.0023810 k( 328) = ( 0.5431709 0.5431709 0.0500219), wk = 0.0023810 k( 329) = ( 0.5575612 0.5575612 0.0666958), wk = 0.0023810 k( 330) = ( 0.5719515 0.5719515 0.0833698), wk = 0.0023810 k( 331) = ( 0.5863418 0.5863418 0.1000438), wk = 0.0023810 k( 332) = ( 0.6007321 0.6007321 0.1167177), wk = 0.0023810 k( 333) = ( 0.6151224 0.6151224 0.1333917), wk = 0.0023810 k( 334) = ( 0.6295126 0.6295126 0.1500656), wk = 0.0023810 k( 335) = ( 0.6439029 0.6439029 0.1667396), wk = 0.0023810 k( 336) = ( 0.6582932 0.6582932 0.1834135), wk = 0.0023810 k( 337) = ( 0.6582932 0.6582932 0.1834135), wk = 0.0023810 k( 338) = ( 0.6556983 0.6556983 0.1886035), wk = 0.0023810 k( 339) = ( 0.6531033 0.6531033 0.1937934), wk = 0.0023810 k( 340) = ( 0.6505083 0.6505083 0.1989834), wk = 0.0023810 k( 341) = ( 0.6479134 0.6479133 0.2041733), wk = 0.0023810 k( 342) = ( 0.6453184 0.6453184 0.2093633), wk = 0.0023810 k( 343) = ( 0.6427234 0.6427234 0.2145532), wk = 0.0023810 k( 344) = ( 0.6401284 0.6401284 0.2197431), wk = 0.0023810 k( 345) = ( 0.6375335 0.6375335 0.2249331), wk = 0.0023810 k( 346) = ( 0.6349385 0.6349385 0.2301230), wk = 0.0023810 k( 347) = ( 0.6323435 0.6323435 0.2353130), wk = 0.0023810 k( 348) = ( 0.6297485 0.6297486 0.2405029), wk = 0.0023810 k( 349) = ( 0.6271536 0.6271536 0.2456928), wk = 0.0023810 k( 350) = ( 0.6245586 0.6245586 0.2508828), wk = 0.0023810 k( 351) = ( 0.6219636 0.6219636 0.2560727), wk = 0.0023810 k( 352) = ( 0.6193687 0.6193687 0.2612627), wk = 0.0023810 k( 353) = ( 0.6167737 0.6167737 0.2664526), wk = 0.0023810 k( 354) = ( 0.6141787 0.6141787 0.2716426), wk = 0.0023810 k( 355) = ( 0.6115837 0.6115837 0.2768325), wk = 0.0023810 k( 356) = ( 0.6089888 0.6089888 0.2820224), wk = 0.0023810 k( 357) = ( 0.6063938 0.6063938 0.2872124), wk = 0.0023810 k( 358) = ( 0.6037988 0.6037988 0.2924023), wk = 0.0023810 k( 359) = ( 0.6012039 0.6012039 0.2975923), wk = 0.0023810 k( 360) = ( 0.5986089 0.5986089 0.3027822), wk = 0.0023810 k( 361) = ( 0.5960139 0.5960139 0.3079721), wk = 0.0023810 k( 362) = ( 0.5934190 0.5934190 0.3131621), wk = 0.0023810 k( 363) = ( 0.5908240 0.5908240 0.3183520), wk = 0.0023810 k( 364) = ( 0.5882290 0.5882290 0.3235420), wk = 0.0023810 k( 365) = ( 0.5856340 0.5856340 0.3287319), wk = 0.0023810 k( 366) = ( 0.5830391 0.5830391 0.3339219), wk = 0.0023810 k( 367) = ( 0.5804441 0.5804441 0.3391118), wk = 0.0023810 k( 368) = ( 0.5778491 0.5778491 0.3443017), wk = 0.0023810 k( 369) = ( 0.5752542 0.5752542 0.3494917), wk = 0.0023810 k( 370) = ( 0.5726592 0.5726592 0.3546816), wk = 0.0023810 k( 371) = ( 0.5700642 0.5700642 0.3598716), wk = 0.0023810 k( 372) = ( 0.5674693 0.5674693 0.3650615), wk = 0.0023810 k( 373) = ( 0.5648743 0.5648743 0.3702515), wk = 0.0023810 k( 374) = ( 0.5622793 0.5622793 0.3754414), wk = 0.0023810 k( 375) = ( 0.5596843 0.5596843 0.3806313), wk = 0.0023810 k( 376) = ( 0.5570894 0.5570894 0.3858213), wk = 0.0023810 k( 377) = ( 0.5544944 0.5544944 0.3910112), wk = 0.0023810 k( 378) = ( 0.5518994 0.5518994 0.3962012), wk = 0.0023810 k( 379) = ( 0.5493045 0.5493044 0.4013911), wk = 0.0023810 k( 380) = ( 0.5467095 0.5467095 0.4065810), wk = 0.0023810 k( 381) = ( 0.5441145 0.5441145 0.4117710), wk = 0.0023810 k( 382) = ( 0.5415195 0.5415195 0.4169609), wk = 0.0023810 k( 383) = ( 0.5389246 0.5389246 0.4221509), wk = 0.0023810 k( 384) = ( 0.5363296 0.5363296 0.4273408), wk = 0.0023810 k( 385) = ( 0.5337346 0.5337346 0.4325307), wk = 0.0023810 k( 386) = ( 0.5311396 0.5311396 0.4377207), wk = 0.0023810 k( 387) = ( 0.5285447 0.5285447 0.4429106), wk = 0.0023810 k( 388) = ( 0.5259497 0.5259497 0.4481006), wk = 0.0023810 k( 389) = ( 0.5233547 0.5233547 0.4532905), wk = 0.0023810 k( 390) = ( 0.5207598 0.5207598 0.4584805), wk = 0.0023810 k( 391) = ( 0.5181648 0.5181648 0.4636704), wk = 0.0023810 k( 392) = ( 0.5155698 0.5155698 0.4688604), wk = 0.0023810 k( 393) = ( 0.5129749 0.5129749 0.4740503), wk = 0.0023810 k( 394) = ( 0.5103799 0.5103799 0.4792402), wk = 0.0023810 k( 395) = ( 0.5077849 0.5077849 0.4844302), wk = 0.0023810 k( 396) = ( 0.5051899 0.5051899 0.4896201), wk = 0.0023810 k( 397) = ( 0.5025950 0.5025950 0.4948101), wk = 0.0023810 k( 398) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0023810 k( 399) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0023810 k( 400) = ( 0.5150756 0.0162717 0.0162718), wk = 0.0023810 k( 401) = ( 0.5301511 0.0325435 0.0325435), wk = 0.0023810 k( 402) = ( 0.5452266 0.0488152 0.0488153), wk = 0.0023810 k( 403) = ( 0.5603022 0.0650870 0.0650870), wk = 0.0023810 k( 404) = ( 0.5753777 0.0813587 0.0813587), wk = 0.0023810 k( 405) = ( 0.5904533 0.0976305 0.0976305), wk = 0.0023810 k( 406) = ( 0.6055288 0.1139023 0.1139023), wk = 0.0023810 k( 407) = ( 0.6206044 0.1301740 0.1301740), wk = 0.0023810 k( 408) = ( 0.6356799 0.1464458 0.1464458), wk = 0.0023810 k( 409) = ( 0.6507555 0.1627175 0.1627175), wk = 0.0023810 k( 410) = ( 0.6658310 0.1789893 0.1789893), wk = 0.0023810 k( 411) = ( 0.6809065 0.1952610 0.1952610), wk = 0.0023810 k( 412) = ( 0.6959821 0.2115328 0.2115328), wk = 0.0023810 k( 413) = ( 0.7110576 0.2278045 0.2278045), wk = 0.0023810 k( 414) = ( 0.7261332 0.2440763 0.2440763), wk = 0.0023810 k( 415) = ( 0.7412087 0.2603480 0.2603480), wk = 0.0023810 k( 416) = ( 0.7562843 0.2766198 0.2766198), wk = 0.0023810 k( 417) = ( 0.7713598 0.2928915 0.2928915), wk = 0.0023810 k( 418) = ( 0.7864354 0.3091633 0.3091633), wk = 0.0023810 k( 419) = ( 0.8015109 0.3254350 0.3254350), wk = 0.0023810 k( 420) = ( 0.8165865 0.3417068 0.3417068), wk = 0.0023810 Dense grid: 30367 G-vectors FFT dimensions: ( 64, 64, 64) Smooth grid: 24121 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.07 Mb ( 104, 46) NL pseudopotentials 0.08 Mb ( 52, 96) Each V/rho on FFT grid 0.06 Mb ( 4096) Each G-vector array 0.00 Mb ( 475) G-vector shells 0.00 Mb ( 428) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.29 Mb ( 104, 184) Each subspace H/S matrix 0.52 Mb ( 184, 184) Each matrix 0.13 Mb ( 96, 2, 46) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./CrWN2.save/charge-density.dat negative rho (up, down): 4.533E+01 0.000E+00 Starting wfc are 62 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 9.7 secs Computing kpt #: 2 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 17.3 secs Computing kpt #: 3 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 22.9 secs Computing kpt #: 4 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 30.5 secs Computing kpt #: 5 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 37.4 secs Computing kpt #: 6 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 43.6 secs Computing kpt #: 7 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 49.8 secs Computing kpt #: 8 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 55.0 secs Computing kpt #: 9 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 61.8 secs Computing kpt #: 10 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 68.6 secs Computing kpt #: 11 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 75.1 secs Computing kpt #: 12 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 81.0 secs Computing kpt #: 13 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 86.4 secs Computing kpt #: 14 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 94.4 secs Computing kpt #: 15 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 102.6 secs Computing kpt #: 16 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 109.2 secs Computing kpt #: 17 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 119.2 secs Computing kpt #: 18 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 126.9 secs Computing kpt #: 19 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 132.9 secs Computing kpt #: 20 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 140.0 secs Computing kpt #: 21 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 146.3 secs Computing kpt #: 22 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 153.5 secs Computing kpt #: 23 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 160.8 secs Computing kpt #: 24 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 166.7 secs Computing kpt #: 25 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 174.4 secs Computing kpt #: 26 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 181.3 secs Computing kpt #: 27 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 188.8 secs Computing kpt #: 28 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 194.2 secs Computing kpt #: 29 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 200.4 secs Computing kpt #: 30 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 205.2 secs Computing kpt #: 31 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 212.3 secs Computing kpt #: 32 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 219.4 secs Computing kpt #: 33 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 225.7 secs Computing kpt #: 34 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 231.4 secs Computing kpt #: 35 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 237.5 secs Computing kpt #: 36 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 245.5 secs Computing kpt #: 37 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 252.6 secs Computing kpt #: 38 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 259.4 secs Computing kpt #: 39 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 263.8 secs Computing kpt #: 40 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 270.8 secs Computing kpt #: 41 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 278.1 secs Computing kpt #: 42 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 283.8 secs Computing kpt #: 43 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 291.1 secs Computing kpt #: 44 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 296.3 secs Computing kpt #: 45 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 303.6 secs Computing kpt #: 46 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 310.5 secs Computing kpt #: 47 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 316.2 secs Computing kpt #: 48 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 322.2 secs Computing kpt #: 49 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 328.7 secs Computing kpt #: 50 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 336.4 secs Computing kpt #: 51 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 343.5 secs Computing kpt #: 52 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 350.3 secs Computing kpt #: 53 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 356.6 secs Computing kpt #: 54 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 363.7 secs Computing kpt #: 55 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 370.3 secs Computing kpt #: 56 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 377.2 secs Computing kpt #: 57 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 382.9 secs Computing kpt #: 58 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 392.0 secs Computing kpt #: 59 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 399.5 secs Computing kpt #: 60 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 406.3 secs Computing kpt #: 61 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 413.8 secs Computing kpt #: 62 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 422.0 secs Computing kpt #: 63 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 428.6 secs Computing kpt #: 64 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 435.8 secs Computing kpt #: 65 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 442.5 secs Computing kpt #: 66 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 449.3 secs Computing kpt #: 67 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 456.7 secs Computing kpt #: 68 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 464.4 secs Computing kpt #: 69 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 472.3 secs Computing kpt #: 70 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 479.0 secs Computing kpt #: 71 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 486.6 secs Computing kpt #: 72 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 492.9 secs Computing kpt #: 73 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 501.0 secs Computing kpt #: 74 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 506.2 secs Computing kpt #: 75 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 513.6 secs Computing kpt #: 76 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 520.5 secs Computing kpt #: 77 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 526.9 secs Computing kpt #: 78 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 532.8 secs Computing kpt #: 79 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 540.1 secs Computing kpt #: 80 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 547.9 secs Computing kpt #: 81 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 554.4 secs Computing kpt #: 82 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 561.8 secs Computing kpt #: 83 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 567.9 secs Computing kpt #: 84 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 575.4 secs Computing kpt #: 85 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 581.7 secs Computing kpt #: 86 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 588.5 secs Computing kpt #: 87 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 593.3 secs Computing kpt #: 88 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 601.0 secs Computing kpt #: 89 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 608.0 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 614.8 secs Computing kpt #: 91 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 620.8 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 626.1 secs Computing kpt #: 93 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 634.8 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 641.2 secs Computing kpt #: 95 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 648.5 secs Computing kpt #: 96 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 652.9 secs Computing kpt #: 97 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 659.8 secs Computing kpt #: 98 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 666.5 secs Computing kpt #: 99 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 673.1 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 679.6 secs Computing kpt #: 101 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 684.5 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 691.7 secs Computing kpt #: 103 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 698.5 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 704.2 secs Computing kpt #: 105 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 710.7 secs Computing kpt #: 106 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 716.6 secs Computing kpt #: 107 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 725.3 secs Computing kpt #: 108 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 732.9 secs Computing kpt #: 109 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 739.1 secs Computing kpt #: 110 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 743.8 secs Computing kpt #: 111 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 750.6 secs Computing kpt #: 112 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 757.5 secs Computing kpt #: 113 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 763.1 secs Computing kpt #: 114 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 771.5 secs Computing kpt #: 115 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 777.0 secs Computing kpt #: 116 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 783.9 secs Computing kpt #: 117 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 791.9 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 797.4 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 803.1 secs Computing kpt #: 120 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 809.8 secs Computing kpt #: 121 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 817.8 secs Computing kpt #: 122 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 824.2 secs Computing kpt #: 123 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 832.1 secs Computing kpt #: 124 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 839.6 secs Computing kpt #: 125 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 845.9 secs Computing kpt #: 126 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 852.9 secs Computing kpt #: 127 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 859.8 secs Computing kpt #: 128 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 864.0 secs Computing kpt #: 129 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 873.6 secs Computing kpt #: 130 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 880.3 secs Computing kpt #: 131 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 886.0 secs Computing kpt #: 132 total cpu time spent up to now is 891.5 secs Computing kpt #: 133 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 897.3 secs Computing kpt #: 134 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 904.5 secs Computing kpt #: 135 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 911.8 secs Computing kpt #: 136 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 918.0 secs Computing kpt #: 137 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 923.1 secs Computing kpt #: 138 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 930.2 secs Computing kpt #: 139 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 937.9 secs Computing kpt #: 140 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 944.1 secs Computing kpt #: 141 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 950.3 secs Computing kpt #: 142 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 956.9 secs Computing kpt #: 143 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 965.2 secs Computing kpt #: 144 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 970.9 secs Computing kpt #: 145 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 977.9 secs Computing kpt #: 146 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 982.8 secs Computing kpt #: 147 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 989.9 secs Computing kpt #: 148 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 998.5 secs Computing kpt #: 149 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1005.1 secs Computing kpt #: 150 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1013.7 secs Computing kpt #: 151 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1020.8 secs Computing kpt #: 152 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1031.2 secs Computing kpt #: 153 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1038.3 secs Computing kpt #: 154 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1042.9 secs Computing kpt #: 155 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1051.5 secs Computing kpt #: 156 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1058.2 secs Computing kpt #: 157 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1064.6 secs Computing kpt #: 158 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1070.9 secs Computing kpt #: 159 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1076.9 secs Computing kpt #: 160 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1084.2 secs Computing kpt #: 161 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1090.4 secs Computing kpt #: 162 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1096.7 secs Computing kpt #: 163 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1102.5 secs Computing kpt #: 164 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1109.8 secs Computing kpt #: 165 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1116.8 secs Computing kpt #: 166 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1123.4 secs Computing kpt #: 167 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1129.8 secs Computing kpt #: 168 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1134.6 secs Computing kpt #: 169 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1141.7 secs Computing kpt #: 170 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1149.9 secs Computing kpt #: 171 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1156.6 secs Computing kpt #: 172 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1162.6 secs Computing kpt #: 173 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1169.8 secs Computing kpt #: 174 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1176.9 secs Computing kpt #: 175 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1183.9 secs Computing kpt #: 176 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1191.8 secs Computing kpt #: 177 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1197.7 secs Computing kpt #: 178 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1205.4 secs Computing kpt #: 179 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1212.0 secs Computing kpt #: 180 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1218.3 secs Computing kpt #: 181 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1224.6 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1233.0 secs Computing kpt #: 183 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 1240.2 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1246.1 secs Computing kpt #: 185 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1254.0 secs Computing kpt #: 186 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1262.3 secs Computing kpt #: 187 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1269.1 secs Computing kpt #: 188 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1275.6 secs Computing kpt #: 189 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1281.9 secs Computing kpt #: 190 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1288.8 secs Computing kpt #: 191 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1297.9 secs Computing kpt #: 192 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1303.5 secs Computing kpt #: 193 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1310.3 secs Computing kpt #: 194 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1316.5 secs Computing kpt #: 195 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1324.0 secs Computing kpt #: 196 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1332.7 secs Computing kpt #: 197 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1340.3 secs Computing kpt #: 198 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1348.6 secs Computing kpt #: 199 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1355.5 secs Computing kpt #: 200 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1362.4 secs Computing kpt #: 201 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1369.5 secs Computing kpt #: 202 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1374.7 secs Computing kpt #: 203 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1381.8 secs Computing kpt #: 204 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1392.1 secs Computing kpt #: 205 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1398.3 secs Computing kpt #: 206 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1405.4 secs Computing kpt #: 207 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1412.2 secs Computing kpt #: 208 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1420.3 secs Computing kpt #: 209 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1426.2 secs Computing kpt #: 210 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1432.1 secs Computing kpt #: 211 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1438.3 secs Computing kpt #: 212 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1447.4 secs Computing kpt #: 213 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1454.3 secs Computing kpt #: 214 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1460.8 secs Computing kpt #: 215 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1467.0 secs Computing kpt #: 216 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1474.8 secs Computing kpt #: 217 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1481.6 secs Computing kpt #: 218 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1487.8 secs Computing kpt #: 219 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1493.2 secs Computing kpt #: 220 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1500.4 secs Computing kpt #: 221 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1508.8 secs Computing kpt #: 222 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1515.3 secs Computing kpt #: 223 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1522.3 secs Computing kpt #: 224 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1529.1 secs Computing kpt #: 225 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1537.0 secs Computing kpt #: 226 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 1543.2 secs Computing kpt #: 227 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1549.5 secs Computing kpt #: 228 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1558.2 secs Computing kpt #: 229 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1564.9 secs Computing kpt #: 230 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1570.8 secs Computing kpt #: 231 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1577.6 secs Computing kpt #: 232 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1584.5 secs Computing kpt #: 233 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1591.8 secs Computing kpt #: 234 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1598.4 secs Computing kpt #: 235 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1605.0 secs Computing kpt #: 236 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1611.9 secs Computing kpt #: 237 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1618.0 secs Computing kpt #: 238 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1625.9 secs Computing kpt #: 239 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1634.1 secs Computing kpt #: 240 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1640.6 secs Computing kpt #: 241 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1646.6 secs Computing kpt #: 242 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1654.8 secs Computing kpt #: 243 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1661.3 secs Computing kpt #: 244 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1667.7 secs Computing kpt #: 245 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1674.2 secs Computing kpt #: 246 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1681.2 secs Computing kpt #: 247 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1689.6 secs Computing kpt #: 248 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1697.5 secs Computing kpt #: 249 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1701.8 secs Computing kpt #: 250 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1709.6 secs Computing kpt #: 251 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1716.5 secs Computing kpt #: 252 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1722.4 secs Computing kpt #: 253 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1729.8 secs Computing kpt #: 254 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1736.4 secs Computing kpt #: 255 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1743.5 secs Computing kpt #: 256 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1751.7 secs Computing kpt #: 257 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1758.8 secs Computing kpt #: 258 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1764.0 secs Computing kpt #: 259 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 1771.2 secs Computing kpt #: 260 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 1777.8 secs Computing kpt #: 261 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 1784.7 secs Computing kpt #: 262 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1791.3 secs Computing kpt #: 263 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1797.0 secs Computing kpt #: 264 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1805.4 secs Computing kpt #: 265 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 1811.7 secs Computing kpt #: 266 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1819.2 secs Computing kpt #: 267 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1827.1 secs Computing kpt #: 268 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1834.0 secs Computing kpt #: 269 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1840.4 secs Computing kpt #: 270 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1848.6 secs Computing kpt #: 271 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1853.1 secs Computing kpt #: 272 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1860.5 secs Computing kpt #: 273 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1867.7 secs Computing kpt #: 274 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1874.4 secs Computing kpt #: 275 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1880.4 secs Computing kpt #: 276 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1886.7 secs Computing kpt #: 277 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1894.3 secs Computing kpt #: 278 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1903.5 secs Computing kpt #: 279 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1910.5 secs Computing kpt #: 280 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1920.1 secs Computing kpt #: 281 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1926.6 secs Computing kpt #: 282 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1936.9 secs Computing kpt #: 283 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1942.1 secs Computing kpt #: 284 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1950.1 secs Computing kpt #: 285 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1957.1 secs Computing kpt #: 286 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1963.1 secs Computing kpt #: 287 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1969.5 secs Computing kpt #: 288 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1974.8 secs Computing kpt #: 289 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1981.5 secs Computing kpt #: 290 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1987.9 secs Computing kpt #: 291 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1994.5 secs Computing kpt #: 292 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2000.1 secs Computing kpt #: 293 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2006.5 secs Computing kpt #: 294 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2013.2 secs Computing kpt #: 295 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2020.1 secs Computing kpt #: 296 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2026.0 secs Computing kpt #: 297 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2032.4 secs Computing kpt #: 298 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2039.8 secs Computing kpt #: 299 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2046.4 secs Computing kpt #: 300 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2052.7 secs Computing kpt #: 301 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2059.6 secs Computing kpt #: 302 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2065.3 secs Computing kpt #: 303 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2073.0 secs Computing kpt #: 304 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2080.0 secs Computing kpt #: 305 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2086.0 secs Computing kpt #: 306 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2091.9 secs Computing kpt #: 307 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2098.1 secs Computing kpt #: 308 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2106.4 secs Computing kpt #: 309 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2112.4 secs Computing kpt #: 310 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2120.3 secs Computing kpt #: 311 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2126.0 secs Computing kpt #: 312 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2133.1 secs Computing kpt #: 313 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2140.0 secs Computing kpt #: 314 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2146.3 secs Computing kpt #: 315 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2152.9 secs Computing kpt #: 316 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2159.9 secs Computing kpt #: 317 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2166.5 secs Computing kpt #: 318 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2173.4 secs Computing kpt #: 319 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2179.6 secs Computing kpt #: 320 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2184.6 secs Computing kpt #: 321 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2191.3 secs Computing kpt #: 322 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2199.8 secs Computing kpt #: 323 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2205.5 secs Computing kpt #: 324 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2211.2 secs Computing kpt #: 325 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2216.4 secs Computing kpt #: 326 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2223.3 secs Computing kpt #: 327 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2230.6 secs Computing kpt #: 328 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2236.5 secs Computing kpt #: 329 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2243.4 secs Computing kpt #: 330 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2250.2 secs Computing kpt #: 331 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2257.7 secs Computing kpt #: 332 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2263.6 secs Computing kpt #: 333 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2272.2 secs Computing kpt #: 334 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2279.7 secs Computing kpt #: 335 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2288.7 secs Computing kpt #: 336 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2294.7 secs Computing kpt #: 337 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2300.4 secs Computing kpt #: 338 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2307.8 secs Computing kpt #: 339 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2315.2 secs Computing kpt #: 340 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2321.3 secs Computing kpt #: 341 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2327.9 secs Computing kpt #: 342 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2333.4 secs Computing kpt #: 343 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2340.9 secs Computing kpt #: 344 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2347.5 secs Computing kpt #: 345 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2353.6 secs Computing kpt #: 346 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2361.4 secs Computing kpt #: 347 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2366.9 secs Computing kpt #: 348 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2374.2 secs Computing kpt #: 349 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2381.5 secs Computing kpt #: 350 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2388.6 secs Computing kpt #: 351 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2394.0 secs Computing kpt #: 352 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2401.0 secs Computing kpt #: 353 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2408.2 secs Computing kpt #: 354 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2414.7 secs Computing kpt #: 355 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2422.0 secs Computing kpt #: 356 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 2428.1 secs Computing kpt #: 357 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2436.1 secs Computing kpt #: 358 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2442.2 secs Computing kpt #: 359 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2449.5 secs Computing kpt #: 360 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2453.8 secs Computing kpt #: 361 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2460.9 secs Computing kpt #: 362 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2469.3 secs Computing kpt #: 363 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2475.7 secs Computing kpt #: 364 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 2481.6 secs Computing kpt #: 365 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 2487.5 secs Computing kpt #: 366 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2494.9 secs Computing kpt #: 367 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2501.2 secs Computing kpt #: 368 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2508.1 secs Computing kpt #: 369 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2512.6 secs Computing kpt #: 370 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2520.6 secs Computing kpt #: 371 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2528.2 secs Computing kpt #: 372 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2534.3 secs Computing kpt #: 373 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2543.4 secs Computing kpt #: 374 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2550.3 secs Computing kpt #: 375 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2557.5 secs Computing kpt #: 376 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2563.6 secs Computing kpt #: 377 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2570.3 secs Computing kpt #: 378 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2575.9 secs Computing kpt #: 379 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2583.6 secs Computing kpt #: 380 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 2590.8 secs Computing kpt #: 381 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2597.0 secs Computing kpt #: 382 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2602.9 secs Computing kpt #: 383 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2610.6 secs Computing kpt #: 384 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2617.5 secs Computing kpt #: 385 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2623.2 secs Computing kpt #: 386 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2630.0 secs Computing kpt #: 387 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2635.1 secs Computing kpt #: 388 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2642.0 secs Computing kpt #: 389 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2649.7 secs Computing kpt #: 390 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2655.7 secs Computing kpt #: 391 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2661.9 secs Computing kpt #: 392 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2668.8 secs Computing kpt #: 393 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2675.9 secs Computing kpt #: 394 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2682.4 secs Computing kpt #: 395 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2689.2 secs Computing kpt #: 396 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2694.6 secs Computing kpt #: 397 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2701.5 secs Computing kpt #: 398 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2709.1 secs Computing kpt #: 399 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2716.6 secs Computing kpt #: 400 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2721.8 secs Computing kpt #: 401 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2727.9 secs Computing kpt #: 402 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2735.2 secs Computing kpt #: 403 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2741.7 secs Computing kpt #: 404 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2749.1 secs Computing kpt #: 405 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2753.5 secs Computing kpt #: 406 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2762.3 secs Computing kpt #: 407 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2769.1 secs Computing kpt #: 408 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2776.0 secs Computing kpt #: 409 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2781.6 secs Computing kpt #: 410 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2788.7 secs Computing kpt #: 411 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2795.6 secs Computing kpt #: 412 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2803.6 secs Computing kpt #: 413 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2809.8 secs Computing kpt #: 414 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2815.4 secs Computing kpt #: 415 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2822.1 secs Computing kpt #: 416 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2832.5 secs Computing kpt #: 417 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2838.8 secs Computing kpt #: 418 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2846.9 secs Computing kpt #: 419 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2852.6 secs Computing kpt #: 420 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2859.7 secs ethr = 2.63E-11, avg # of iterations =120.0 total cpu time spent up to now is 2859.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3027 PWs) bands (ev): ************************************-176.0418-176.0418-138.2990-138.2990 -92.7608 -92.7608 -64.3345 -64.3345 -63.4550 -63.4550 -61.5194 -61.5194 -51.0531 -51.0531 -18.7388 -18.7388 -18.6270 -18.6270 -16.7941 -16.7941 -16.4897 -16.4897 -16.4227 -16.4227 -11.1052 -11.1052 -8.1681 -8.1681 0.3680 0.3680 4.1391 4.1391 9.1204 9.1204 9.4487 9.4487 10.1292 10.1292 14.3473 14.3473 15.9823 15.9907 k = 0.0077-0.0131-0.0080 ( 3023 PWs) bands (ev): ************************************-176.0437-176.0376-138.2998-138.2939 -92.7601 -92.7601 -64.3343 -64.3342 -63.4548 -63.4548 -61.5195 -61.5194 -51.0228 -51.0197 -18.7335 -18.7334 -18.6216 -18.6214 -16.7931 -16.7895 -16.4929 -16.4895 -16.4254 -16.4235 -11.1059 -11.0994 -8.1688 -8.1575 0.3668 0.3725 4.1331 4.1525 9.0861 9.1020 9.4431 9.4492 10.1475 10.1583 14.3430 14.3523 15.9668 15.9790 k = 0.0154-0.0263-0.0159 ( 3019 PWs) bands (ev): ************************************-176.0412-176.0360-138.2994-138.2906 -92.7594 -92.7594 -64.3343 -64.3341 -63.4548 -63.4547 -61.5195 -61.5193 -50.9558 -50.9510 -18.7298 -18.7295 -18.6184 -18.6181 -16.7929 -16.7857 -16.4936 -16.4870 -16.4250 -16.4211 -11.1050 -11.0915 -8.1707 -8.1486 0.3668 0.3783 4.1325 4.1711 9.0066 9.0342 9.4332 9.4420 10.2078 10.2271 14.3388 14.3578 15.9646 15.9846 k = 0.0231-0.0394-0.0239 ( 3016 PWs) bands (ev): ************************************-176.0399-176.0331-138.2934-138.2892 -92.7589 -92.7589 -64.3344 -64.3342 -63.4548 -63.4548 -61.5195 -61.5191 -50.9360 -50.9317 -18.7289 -18.7284 -18.6160 -18.6154 -16.7914 -16.7806 -16.4938 -16.4835 -16.4247 -16.4189 -11.1022 -11.0819 -8.1689 -8.1340 0.3685 0.3860 4.1324 4.1906 8.8942 8.9300 9.4191 9.4279 10.2965 10.3218 14.3349 14.3637 15.9651 15.9913 k = 0.0308-0.0526-0.0318 ( 3018 PWs) bands (ev): ************************************-176.0401-176.0390-138.2982-138.2899 -92.7592 -92.7592 -64.3348 -64.3345 -63.4552 -63.4551 -61.5195 -61.5191 -50.9780 -50.9668 -18.7328 -18.7322 -18.6155 -18.6148 -16.7921 -16.7776 -16.4965 -16.4822 -16.4267 -16.4193 -11.0971 -11.0702 -8.1815 -8.1407 0.3710 0.3943 4.1299 4.2070 8.7601 8.8014 9.3992 9.4070 10.4011 10.4298 14.3304 14.3687 15.9573 16.0029 k = 0.0385-0.0657-0.0398 ( 3022 PWs) bands (ev): ************************************-176.0440-176.0407-138.3006-138.2960 -92.7598 -92.7598 -64.3352 -64.3348 -63.4556 -63.4555 -61.5197 -61.5191 -51.0348 -51.0265 -18.7354 -18.7346 -18.6152 -18.6144 -16.7941 -16.7759 -16.5022 -16.4835 -16.4315 -16.4224 -11.0902 -11.0562 -8.2002 -8.1436 0.3747 0.4035 4.1290 4.2238 8.6114 8.6569 9.3735 9.3810 10.5137 10.5448 14.3253 14.3736 15.9507 16.0033 k = 0.0462-0.0789-0.0478 ( 3025 PWs) bands (ev): ************************************-176.0455-176.0403-138.3036-138.2977 -92.7603 -92.7603 -64.3358 -64.3353 -63.4561 -63.4561 -61.5196 -61.5190 -51.0458 -51.0371 -18.7378 -18.7368 -18.6184 -18.6174 -16.7923 -16.7701 -16.5062 -16.4835 -16.4345 -16.4235 -11.0810 -11.0400 -8.2124 -8.1455 0.3802 0.4144 4.1354 4.2480 8.4537 8.5027 9.3413 9.3493 10.6290 10.6623 14.3197 14.3778 15.8943 15.9688 k = 0.0538-0.0920-0.0557 ( 3028 PWs) bands (ev): ************************************-176.0469-176.0419-138.3047-138.3009 -92.7607 -92.7607 -64.3362 -64.3357 -63.4566 -63.4565 -61.5198 -61.5191 -51.0948 -51.0831 -18.7369 -18.7358 -18.6180 -18.6168 -16.7918 -16.7651 -16.5142 -16.4862 -16.4410 -16.4282 -11.0684 -11.0207 -8.2229 -8.1473 0.3880 0.4272 4.1421 4.2718 8.2893 8.3419 9.3042 9.3133 10.7432 10.7790 14.3126 14.3808 15.8275 15.9039 k = 0.0615-0.1051-0.0637 ( 3024 PWs) bands (ev): ************************************-176.0451-176.0364-138.2980-138.2943 -92.7600 -92.7600 -64.3367 -64.3360 -63.4570 -63.4569 -61.5196 -61.5187 -51.0364 -51.0273 -18.7369 -18.7357 -18.6135 -18.6121 -16.7872 -16.7567 -16.5138 -16.4823 -16.4395 -16.4246 -11.0527 -10.9987 -8.2169 -8.1282 0.3979 0.4426 4.1594 4.3054 8.1195 8.1756 9.2631 9.2739 10.8557 10.8942 14.3039 14.3823 15.7502 15.8241 k = 0.0692-0.1183-0.0716 ( 3024 PWs) bands (ev): ************************************-176.0490-176.0377-138.3010-138.2918 -92.7598 -92.7598 -64.3371 -64.3364 -63.4575 -63.4574 -61.5197 -61.5188 -51.0280 -51.0242 -18.7344 -18.7330 -18.6096 -18.6081 -16.7855 -16.7507 -16.5197 -16.4847 -16.4442 -16.4269 -11.0359 -10.9747 -8.2271 -8.1257 0.4086 0.4584 4.1762 4.3395 7.9461 8.0046 9.2165 9.2289 10.9638 11.0049 14.2908 14.3798 15.6606 15.7389 k = 0.0769-0.1314-0.0796 ( 3026 PWs) bands (ev): ************************************-176.0498-176.0382-138.3025-138.2914 -92.7600 -92.7600 -64.3378 -64.3370 -63.4582 -63.4580 -61.5198 -61.5187 -51.0233 -51.0154 -18.7366 -18.7351 -18.6062 -18.6046 -16.7843 -16.7448 -16.5259 -16.4855 -16.4484 -16.4293 -11.0171 -10.9488 -8.2374 -8.1264 0.4204 0.4754 4.1955 4.3752 7.7687 7.8308 9.1662 9.1803 11.0653 11.1097 14.2728 14.3725 15.5752 15.6549 k = 0.0846-0.1446-0.0876 ( 3025 PWs) bands (ev): ************************************-176.0502-176.0377-138.3039-138.2913 -92.7597 -92.7597 -64.3384 -64.3375 -63.4587 -63.4586 -61.5198 -61.5187 -51.0267 -51.0213 -18.7374 -18.7358 -18.5981 -18.5965 -16.7816 -16.7367 -16.5320 -16.4852 -16.4521 -16.4310 -10.9954 -10.9203 -8.2476 -8.1251 0.4340 0.4937 4.2172 4.4119 7.5889 7.6547 9.1124 9.1279 11.1604 11.2079 14.2478 14.3585 15.4953 15.5756 k = 0.0923-0.1577-0.0955 ( 3015 PWs) bands (ev): ************************************-176.0423-176.0304-138.2950-138.2814 -92.7579 -92.7579 -64.3388 -64.3378 -63.4591 -63.4590 -61.5194 -61.5182 -50.9058 -50.8952 -18.7324 -18.7307 -18.5879 -18.5861 -16.7747 -16.7261 -16.5284 -16.4796 -16.4479 -16.4241 -10.9705 -10.8883 -8.2318 -8.0986 0.4509 0.5152 4.2506 4.4607 7.4083 7.4782 9.0550 9.0721 11.2487 11.3005 14.2156 14.3370 15.4253 15.5056 k = 0.1000-0.1709-0.1035 ( 3015 PWs) bands (ev): ************************************-176.0399-176.0310-138.2910-138.2823 -92.7577 -92.7577 -64.3396 -64.3385 -63.4599 -63.4597 -61.5194 -61.5181 -50.9266 -50.9206 -18.7344 -18.7327 -18.5818 -18.5799 -16.7715 -16.7174 -16.5340 -16.4792 -16.4514 -16.4252 -10.9435 -10.8542 -8.2358 -8.0925 0.4674 0.5365 4.2752 4.4998 7.2252 7.3000 8.9937 9.0121 11.3282 11.3836 14.1723 14.3043 15.3697 15.4475 k = 0.1077-0.1840-0.1114 ( 3019 PWs) bands (ev): ************************************-176.0458-176.0341-138.2961-138.2862 -92.7582 -92.7582 -64.3405 -64.3393 -63.4608 -63.4607 -61.5195 -61.5181 -50.9660 -50.9605 -18.7394 -18.7377 -18.5750 -18.5732 -16.7695 -16.7088 -16.5447 -16.4830 -16.4593 -16.4303 -10.9162 -10.8186 -8.2600 -8.1007 0.4843 0.5576 4.3022 4.5394 7.0403 7.1201 8.9294 8.9490 11.3982 11.4574 14.1177 14.2595 15.3181 15.3961 k = 0.1154-0.1971-0.1194 ( 3019 PWs) bands (ev): ************************************-176.0455-176.0342-138.2955-138.2863 -92.7581 -92.7581 -64.3413 -64.3402 -63.4617 -63.4615 -61.5194 -61.5180 -50.9654 -50.9597 -18.7424 -18.7407 -18.5677 -18.5658 -16.7668 -16.7003 -16.5499 -16.4824 -16.4619 -16.4303 -10.8855 -10.7803 -8.2690 -8.0984 0.5034 0.5807 4.3344 4.5832 6.8549 6.9406 8.8623 8.8829 11.4592 11.5220 14.0529 14.2033 15.2851 15.3614 k = 0.1231-0.2103-0.1274 ( 3017 PWs) bands (ev): ************************************-176.0442-176.0323-138.2937-138.2822 -92.7575 -92.7575 -64.3422 -64.3410 -63.4626 -63.4624 -61.5192 -61.5177 -50.9149 -50.9089 -18.7452 -18.7436 -18.5592 -18.5573 -16.7625 -16.6908 -16.5524 -16.4813 -16.4621 -16.4277 -10.8520 -10.7394 -8.2730 -8.0902 0.5240 0.6051 4.3722 4.6307 6.6693 6.7622 8.7929 8.8144 11.5108 11.5766 13.9787 14.1363 15.2662 15.3403 k = 0.1308-0.2234-0.1353 ( 3015 PWs) bands (ev): ************************************-176.0404-176.0315-138.2896-138.2814 -92.7570 -92.7570 -64.3431 -64.3418 -63.4635 -63.4633 -61.5191 -61.5175 -50.8949 -50.8879 -18.7465 -18.7448 -18.5495 -18.5476 -16.7594 -16.6824 -16.5558 -16.4810 -16.4630 -16.4259 -10.8160 -10.6953 -8.2749 -8.0833 0.5462 0.6305 4.4100 4.6766 6.4835 6.5854 8.7213 8.7437 11.5517 11.6203 13.8976 14.0605 15.2553 15.3298 k = 0.1385-0.2366-0.1433 ( 3015 PWs) bands (ev): ************************************-176.0410-176.0347-138.2895-138.2838 -92.7568 -92.7568 -64.3441 -64.3427 -63.4645 -63.4643 -61.5190 -61.5173 -50.8987 -50.8878 -18.7516 -18.7500 -18.5385 -18.5366 -16.7576 -16.6753 -16.5602 -16.4815 -16.4640 -16.4248 -10.7800 -10.6503 -8.2867 -8.0865 0.5685 0.6554 4.4485 4.7205 6.2978 6.4106 8.6481 8.6711 11.5817 11.6524 13.8103 13.9769 15.2550 15.3293 k = 0.1462-0.2497-0.1512 ( 3009 PWs) bands (ev): ************************************-176.0398-176.0292-138.2879-138.2785 -92.7555 -92.7555 -64.3449 -64.3435 -63.4653 -63.4651 -61.5188 -61.5170 -50.8119 -50.8032 -18.7528 -18.7512 -18.5234 -18.5215 -16.7543 -16.6677 -16.5602 -16.4776 -16.4604 -16.4199 -10.7394 -10.6010 -8.2928 -8.0748 0.5921 0.6821 4.4944 4.7676 6.1147 6.2421 8.5739 8.5975 11.6011 11.6731 13.7206 13.8892 15.2602 15.3354 k = 0.1538-0.2629-0.1592 ( 3009 PWs) bands (ev): ************************************-176.0404-176.0294-138.2884-138.2803 -92.7553 -92.7553 -64.3461 -64.3446 -63.4665 -63.4662 -61.5186 -61.5168 -50.8108 -50.8032 -18.7585 -18.7569 -18.5140 -18.5121 -16.7530 -16.6638 -16.5605 -16.4787 -16.4583 -16.4161 -10.6988 -10.5509 -8.3074 -8.0745 0.6158 0.7083 4.5369 4.8058 5.9321 6.0796 8.4973 8.5214 11.6089 11.6809 13.6290 13.7980 15.2690 15.3459 k = 0.1615-0.2760-0.1672 ( 3009 PWs) bands (ev): ************************************-176.0401-176.0297-138.2878-138.2804 -92.7551 -92.7550 -64.3472 -64.3457 -63.4676 -63.4674 -61.5185 -61.5166 -50.8098 -50.8025 -18.7634 -18.7619 -18.5033 -18.5014 -16.7530 -16.6630 -16.5591 -16.4810 -16.4557 -16.4119 -10.6555 -10.4986 -8.3168 -8.0721 0.6400 0.7347 4.5788 4.8349 5.7522 5.9284 8.4197 8.4442 11.6056 11.6767 13.5385 13.7061 15.2797 15.3585 k = 0.1692-0.2891-0.1751 ( 3004 PWs) bands (ev): ************************************-176.0376-176.0238-138.2840-138.2729 -92.7539 -92.7539 -64.3482 -64.3466 -63.4686 -63.4684 -61.5181 -61.5162 -50.7868 -50.7827 -18.7658 -18.7643 -18.4894 -18.4875 -16.7520 -16.6630 -16.5526 -16.4789 -16.4484 -16.4038 -10.6083 -10.4432 -8.3151 -8.0556 0.6649 0.7620 4.6204 4.8518 5.5780 5.7962 8.3420 8.3669 11.5913 11.6602 13.4504 13.6149 15.2912 15.3718 k = 0.1769-0.3023-0.1831 ( 3004 PWs) bands (ev): ************************************-176.0371-176.0231-138.2824-138.2722 -92.7536 -92.7536 -64.3493 -64.3477 -63.4698 -63.4695 -61.5181 -61.5162 -50.8350 -50.8325 -18.7713 -18.7699 -18.4744 -18.4725 -16.7539 -16.6670 -16.5500 -16.4843 -16.4458 -16.3984 -10.5606 -10.3861 -8.3199 -8.0501 0.6893 0.7880 4.6526 4.8437 5.4106 5.6896 8.2631 8.2884 11.5654 11.6315 13.3651 13.5248 15.2986 15.3821 k = 0.1846-0.3154-0.1910 ( 3004 PWs) bands (ev): ************************************-176.0378-176.0230-138.2835-138.2705 -92.7533 -92.7533 -64.3505 -64.3489 -63.4710 -63.4707 -61.5179 -61.5159 -50.8404 -50.8373 -18.7793 -18.7779 -18.4608 -18.4589 -16.7553 -16.6714 -16.5450 -16.4868 -16.4400 -16.3906 -10.5124 -10.3273 -8.3289 -8.0450 0.7132 0.8123 4.6710 4.8094 5.2586 5.6182 8.1837 8.2092 11.5282 11.5910 13.2840 13.4373 15.3037 15.3894 k = 0.1923-0.3286-0.1990 ( 3006 PWs) bands (ev): ************************************-176.0393-176.0237-138.2840-138.2719 -92.7533 -92.7533 -64.3518 -64.3501 -63.4723 -63.4720 -61.5179 -61.5159 -50.8851 -50.8830 -18.7857 -18.7844 -18.4484 -18.4465 -16.7584 -16.6781 -16.5433 -16.4937 -16.4352 -16.3833 -10.4622 -10.2662 -8.3398 -8.0434 0.7361 0.8357 4.6487 4.7498 5.1392 5.5860 8.1037 8.1294 11.4803 11.5398 13.2065 13.3522 15.3045 15.3927 k = 0.2000-0.3417-0.2070 ( 3003 PWs) bands (ev): ************************************-176.0379-176.0227-138.2824-138.2708 -92.7525 -92.7525 -64.3529 -64.3512 -63.4734 -63.4731 -61.5177 -61.5156 -50.8203 -50.8186 -18.7908 -18.7895 -18.4321 -18.4302 -16.7595 -16.6829 -16.5385 -16.4958 -16.4257 -16.3726 -10.4091 -10.2022 -8.3468 -8.0376 0.7581 0.8577 4.5735 4.6693 5.0805 5.5900 8.0241 8.0500 11.4222 11.4791 13.1341 13.2710 15.3002 15.3899 k = 0.2077-0.3548-0.2149 ( 3004 PWs) bands (ev): ************************************-176.0371-176.0226-138.2826-138.2693 -92.7523 -92.7523 -64.3543 -64.3525 -63.4748 -63.4745 -61.5175 -61.5154 -50.8900 -50.8852 -18.7972 -18.7959 -18.4208 -18.4189 -16.7646 -16.6927 -16.5346 -16.4982 -16.4157 -16.3625 -10.3551 -10.1370 -8.3541 -8.0288 0.7778 0.8771 4.4582 4.5520 5.0768 5.6145 7.9444 7.9702 11.3536 11.4095 13.0648 13.1925 15.2913 15.3826 k = 0.2154-0.3680-0.2229 ( 3002 PWs) bands (ev): ************************************-176.0355-176.0217-138.2793-138.2680 -92.7517 -92.7517 -64.3555 -64.3537 -63.4760 -63.4757 -61.5173 -61.5152 -50.8824 -50.8772 -18.8029 -18.8017 -18.4047 -18.4028 -16.7680 -16.7003 -16.5314 -16.5003 -16.4038 -16.3507 -10.2990 -10.0690 -8.3560 -8.0188 0.7951 0.8932 4.3270 4.4145 5.1097 5.6583 7.8654 7.8914 11.2760 11.3330 12.9992 13.1174 15.2781 15.3702 k = 0.2231-0.3811-0.2308 ( 3003 PWs) bands (ev): ************************************-176.0357-176.0235-138.2790-138.2693 -92.7515 -92.7515 -64.3568 -64.3550 -63.4773 -63.4770 -61.5172 -61.5150 -50.9190 -50.9125 -18.8104 -18.8092 -18.3912 -18.3893 -16.7743 -16.7109 -16.5295 -16.5031 -16.3916 -16.3394 -10.2424 -9.9993 -8.3664 -8.0136 0.8088 0.9050 4.1884 4.2697 5.1570 5.7112 7.7864 7.8125 11.1900 11.2497 12.9356 13.0450 15.2557 15.3470 k = 0.2308-0.3943-0.2388 ( 3000 PWs) bands (ev): ************************************-176.0354-176.0252-138.2775-138.2712 -92.7506 -92.7506 -64.3580 -64.3562 -63.4785 -63.4782 -61.5170 -61.5148 -50.8945 -50.8842 -18.8138 -18.8126 -18.3741 -18.3721 -16.7800 -16.7207 -16.5281 -16.5056 -16.3766 -16.3256 -10.1843 -9.9265 -8.3770 -8.0085 0.8192 0.9125 4.0514 4.1275 5.2153 5.7727 7.7083 7.7345 11.0967 11.1609 12.8745 12.9758 15.2303 15.3207 k = 0.2385-0.4074-0.2468 ( 3000 PWs) bands (ev): ************************************-176.0364-176.0258-138.2773-138.2718 -92.7502 -92.7502 -64.3593 -64.3575 -63.4798 -63.4795 -61.5168 -61.5147 -50.8884 -50.8795 -18.8208 -18.8197 -18.3595 -18.3576 -16.7858 -16.7304 -16.5281 -16.5090 -16.3621 -16.3126 -10.1257 -9.8535 -8.3861 -8.0018 0.8233 0.9129 3.9159 3.9890 5.2788 5.8393 7.6309 7.6573 10.9981 11.0681 12.8142 12.9088 15.1998 15.2881 k = 0.2462-0.4206-0.2547 ( 3004 PWs) bands (ev): ************************************-176.0383-176.0276-138.2791-138.2736 -92.7506 -92.7506 -64.3608 -64.3590 -63.4813 -63.4810 -61.5167 -61.5145 -50.9345 -50.9257 -18.8310 -18.8299 -18.3492 -18.3472 -16.7936 -16.7417 -16.5288 -16.5123 -16.3487 -16.3010 -10.0665 -9.7787 -8.3982 -7.9969 0.8201 0.9055 3.7862 3.8578 5.3426 5.9070 7.5541 7.5807 10.8941 10.9705 12.7538 12.8440 15.1640 15.2507 k = 0.2538-0.4337-0.2627 ( 3004 PWs) bands (ev): ************************************-176.0386-176.0281-138.2792-138.2737 -92.7502 -92.7502 -64.3621 -64.3603 -63.4827 -63.4824 -61.5165 -61.5143 -50.9331 -50.9249 -18.8377 -18.8367 -18.3351 -18.3331 -16.8000 -16.7514 -16.5291 -16.5147 -16.3332 -16.2872 -10.0059 -9.7019 -8.4056 -7.9869 0.8095 0.8902 3.6657 3.7371 5.4110 5.9789 7.4785 7.5054 10.7872 10.8702 12.6938 12.7815 15.1247 15.2107 k = 0.2615-0.4468-0.2706 ( 3000 PWs) bands (ev): ************************************-176.0323-176.0272-138.2756-138.2698 -92.7491 -92.7491 -64.3632 -64.3614 -63.4838 -63.4835 -61.5163 -61.5141 -50.8651 -50.8488 -18.8399 -18.8389 -18.3196 -18.3176 -16.8031 -16.7574 -16.5298 -16.5174 -16.3155 -16.2712 -9.9436 -9.6223 -8.3997 -7.9691 0.7898 0.8654 3.5574 3.6293 5.4840 6.0555 7.4043 7.4316 10.6789 10.7688 12.6339 12.7213 15.0783 15.1650 k = 0.2692-0.4600-0.2786 ( 3001 PWs) bands (ev): ************************************-176.0320-176.0267-138.2735-138.2687 -92.7489 -92.7489 -64.3646 -64.3628 -63.4852 -63.4849 -61.5161 -61.5139 -50.8784 -50.8592 -18.8495 -18.8485 -18.3050 -18.3031 -16.8102 -16.7675 -16.5299 -16.5191 -16.2999 -16.2576 -9.8815 -9.5428 -8.4022 -7.9537 0.7588 0.8292 3.4589 3.5331 5.5550 6.1298 7.3312 7.3592 10.5678 10.6640 12.5726 12.6621 15.0283 15.1140 k = 0.2769-0.4731-0.2866 ( 3001 PWs) bands (ev): ************************************-176.0324-176.0307-138.2772-138.2671 -92.7486 -92.7486 -64.3659 -64.3641 -63.4865 -63.4862 -61.5159 -61.5138 -50.8892 -50.8676 -18.8565 -18.8555 -18.2902 -18.2882 -16.8185 -16.7786 -16.5309 -16.5215 -16.2833 -16.2430 -9.8209 -9.4624 -8.4105 -7.9418 0.7169 0.7821 3.3740 3.4516 5.6271 6.2049 7.2596 7.2885 10.4557 10.5571 12.5108 12.6040 14.9717 15.0526 k = 0.2846-0.4863-0.2945 ( 3001 PWs) bands (ev): ************************************-176.0328-176.0310-138.2778-138.2667 -92.7482 -92.7482 -64.3672 -64.3654 -63.4878 -63.4875 -61.5157 -61.5136 -50.8879 -50.8668 -18.8634 -18.8625 -18.2761 -18.2741 -16.8256 -16.7883 -16.5320 -16.5238 -16.2670 -16.2286 -9.7596 -9.3813 -8.4146 -7.9255 0.6620 0.7229 3.3031 3.3849 5.6997 6.2796 7.1896 7.2197 10.3438 10.4508 12.4483 12.5468 14.9120 14.9965 k = 0.2923-0.4994-0.3025 ( 3003 PWs) bands (ev): ************************************-176.0344-176.0322-138.2788-138.2678 -92.7482 -92.7482 -64.3685 -64.3668 -63.4891 -63.4888 -61.5155 -61.5135 -50.9101 -50.8879 -18.8713 -18.8704 -18.2637 -18.2618 -16.8349 -16.8001 -16.5339 -16.5267 -16.2510 -16.2146 -9.6996 -9.3003 -8.4189 -7.9088 0.5938 0.6517 3.2467 3.3334 5.7710 6.3517 7.1213 7.1531 10.2322 10.3441 12.3852 12.4899 14.8458 14.9294 k = 0.3000-0.5126-0.3104 ( 3003 PWs) bands (ev): ************************************-176.0352-176.0302-138.2798-138.2693 -92.7478 -92.7478 -64.3698 -64.3681 -63.4905 -63.4902 -61.5152 -61.5132 -50.9003 -50.8786 -18.8778 -18.8770 -18.2527 -18.2508 -16.8408 -16.8083 -16.5362 -16.5299 -16.2320 -16.1974 -9.6392 -9.2195 -8.4210 -7.8899 0.5129 0.5695 3.2058 3.2974 5.8439 6.4241 7.0545 7.0892 10.1229 10.2397 12.3218 12.4334 14.7758 14.8635 k = 0.3077-0.5257-0.3184 ( 3003 PWs) bands (ev): ************************************-176.0359-176.0304-138.2805-138.2691 -92.7474 -92.7474 -64.3711 -64.3694 -63.4917 -63.4914 -61.5150 -61.5130 -50.8988 -50.8775 -18.8845 -18.8837 -18.2389 -18.2370 -16.8478 -16.8174 -16.5375 -16.5320 -16.2159 -16.1831 -9.5802 -9.1399 -8.4185 -7.8667 0.4200 0.4769 3.1788 3.2754 5.9150 6.4927 6.9901 7.0291 10.0149 10.1359 12.2580 12.3771 14.7017 14.7870 k = 0.3154-0.5388-0.3264 ( 2995 PWs) bands (ev): ************************************-176.0324-176.0267-138.2696-138.2668 -92.7457 -92.7457 -64.3721 -64.3704 -63.4927 -63.4925 -61.5144 -61.5125 -50.7887 -50.7662 -18.8880 -18.8872 -18.2219 -18.2200 -16.8507 -16.8225 -16.5356 -16.5308 -16.1896 -16.1586 -9.5179 -9.0590 -8.4017 -7.8303 0.3171 0.3756 3.1671 3.2678 5.9888 6.5598 6.9284 6.9750 9.9110 10.0363 12.1950 12.3220 14.6268 14.7162 k = 0.3231-0.5520-0.3343 ( 2995 PWs) bands (ev): ************************************-176.0321-176.0250-138.2669-138.2657 -92.7454 -92.7454 -64.3733 -64.3717 -63.4940 -63.4937 -61.5141 -61.5122 -50.7730 -50.7527 -18.8951 -18.8944 -18.2112 -18.2094 -16.8554 -16.8291 -16.5352 -16.5308 -16.1737 -16.1444 -9.4604 -8.9853 -8.3882 -7.7971 0.2042 0.2651 3.1660 3.2711 6.0567 6.6140 6.8690 6.9293 9.8093 9.9385 12.1310 12.2658 14.5471 14.6390 k = 0.3308-0.5651-0.3423 ( 2993 PWs) bands (ev): ************************************-176.0321-176.0243-138.2663-138.2636 -92.7447 -92.7447 -64.3744 -64.3728 -63.4951 -63.4948 -61.5139 -61.5120 -50.7670 -50.7481 -18.9013 -18.9006 -18.1942 -18.1924 -16.8617 -16.8371 -16.5362 -16.5324 -16.1575 -16.1298 -9.4045 -8.9163 -8.3666 -7.7626 0.0837 0.1475 3.1764 3.2848 6.1213 6.6508 6.8126 6.8997 9.7120 9.8439 12.0670 12.2093 14.4652 14.5590 k = 0.3385-0.5783-0.3502 ( 2994 PWs) bands (ev): ************************************-176.0328-176.0248-138.2656-138.2638 -92.7445 -92.7445 -64.3756 -64.3741 -63.4963 -63.4960 -61.5137 -61.5118 -50.7545 -50.7398 -18.9078 -18.9072 -18.1846 -18.1829 -16.8665 -16.8436 -16.5377 -16.5342 -16.1429 -16.1167 -9.3515 -8.8561 -8.3401 -7.7286 -0.0427 0.0241 3.1963 3.3074 6.1820 6.6594 6.7591 6.8948 9.6198 9.7536 12.0029 12.1526 14.3812 14.4763 k = 0.3462-0.5914-0.3582 ( 2989 PWs) bands (ev): ************************************-176.0259-176.0226-138.2623-138.2602 -92.7432 -92.7432 -64.3765 -64.3750 -63.4971 -63.4969 -61.5134 -61.5116 -50.6890 -50.6702 -18.9083 -18.9077 -18.1713 -18.1696 -16.8668 -16.8452 -16.5354 -16.5322 -16.1304 -16.1054 -9.2963 -8.7992 -8.2965 -7.6832 -0.1724 -0.1032 3.2259 3.3392 6.2396 6.6410 6.7102 6.9167 9.5348 9.6691 11.9393 12.0965 14.2983 14.3944 k = 0.3538-0.6046-0.3662 ( 2990 PWs) bands (ev): ************************************-176.0269-176.0243-138.2645-138.2610 -92.7430 -92.7430 -64.3776 -64.3761 -63.4982 -63.4980 -61.5132 -61.5115 -50.6877 -50.6697 -18.9158 -18.9153 -18.1592 -18.1576 -16.8730 -16.8528 -16.5368 -16.5339 -16.1173 -16.0938 -9.2508 -8.7608 -8.2495 -7.6462 -0.3061 -0.2344 3.2615 3.3762 6.2883 6.6058 6.6660 6.9479 9.4555 9.5894 11.8751 12.0389 14.2130 14.3105 k = 0.3615-0.6177-0.3741 ( 2990 PWs) bands (ev): ************************************-176.0262-176.0242-138.2655-138.2600 -92.7427 -92.7427 -64.3786 -64.3772 -63.4993 -63.4991 -61.5130 -61.5113 -50.6566 -50.6392 -18.9219 -18.9213 -18.1501 -18.1485 -16.8776 -16.8588 -16.5353 -16.5327 -16.1043 -16.0821 -9.2056 -8.7310 -8.1907 -7.6051 -0.4415 -0.3675 3.3033 3.4192 6.3290 6.5647 6.6288 6.9815 9.3849 9.5178 11.8117 11.9816 14.1284 14.2263 k = 0.3692-0.6308-0.3821 ( 2984 PWs) bands (ev): ************************************-176.0243-176.0214-138.2641-138.2543 -92.7413 -92.7413 -64.3793 -64.3780 -63.5000 -63.4997 -61.5127 -61.5112 -50.6106 -50.5964 -18.9239 -18.9234 -18.1309 -18.1294 -16.8822 -16.8647 -16.5348 -16.5324 -16.0882 -16.0674 -9.1579 -8.7046 -8.1186 -7.5557 -0.5763 -0.5008 3.3511 3.4672 6.3567 6.5226 6.6019 7.0117 9.3237 9.4545 11.7489 11.9246 14.0466 14.1444 k = 0.3769-0.6440-0.3900 ( 2986 PWs) bands (ev): ************************************-176.0264-176.0238-138.2660-138.2565 -92.7414 -92.7414 -64.3804 -64.3791 -63.5010 -63.5008 -61.5125 -61.5110 -50.6165 -50.6007 -18.9303 -18.9298 -18.1231 -18.1215 -16.8869 -16.8707 -16.5374 -16.5353 -16.0766 -16.0572 -9.1205 -8.6942 -8.0454 -7.5133 -0.7114 -0.6345 3.4022 3.5177 6.3666 6.4804 6.5874 7.0312 9.2716 9.3982 11.6860 11.8668 13.9648 14.0613 k = 0.3846-0.6571-0.3980 ( 2990 PWs) bands (ev): ************************************-176.0301-176.0266-138.2718-138.2588 -92.7417 -92.7417 -64.3814 -64.3802 -63.5021 -63.5019 -61.5124 -61.5110 -50.6414 -50.6264 -18.9385 -18.9381 -18.1159 -18.1145 -16.8928 -16.8777 -16.5390 -16.5371 -16.0682 -16.0501 -9.0888 -8.6954 -7.9671 -7.4701 -0.8446 -0.7673 3.4564 3.5708 6.3595 6.4397 6.5855 7.0419 9.2294 9.3508 11.6231 11.8079 13.8844 13.9793 k = 0.3923-0.6703-0.4060 ( 2986 PWs) bands (ev): ************************************-176.0290-176.0247-138.2691-138.2593 -92.7407 -92.7407 -64.3821 -64.3810 -63.5028 -63.5026 -61.5121 -61.5108 -50.6031 -50.5899 -18.9401 -18.9397 -18.1041 -18.1028 -16.8923 -16.8783 -16.5395 -16.5377 -16.0568 -16.0400 -9.0522 -8.6896 -7.8822 -7.4176 -0.9744 -0.8969 3.5140 3.6274 6.3409 6.4012 6.5921 7.0452 9.1996 9.3151 11.5621 11.7493 13.8092 13.9022 k = 0.4000-0.6834-0.4139 ( 2985 PWs) bands (ev): ************************************-176.0268-176.0233-138.2618-138.2604 -92.7403 -92.7403 -64.3828 -64.3817 -63.5035 -63.5033 -61.5120 -61.5107 -50.6322 -50.6243 -18.9434 -18.9431 -18.0931 -18.0918 -16.8999 -16.8872 -16.5405 -16.5389 -16.0423 -16.0271 -9.0136 -8.6837 -7.7955 -7.3654 -1.1011 -1.0239 3.5724 3.6837 6.3160 6.3649 6.5997 7.0378 9.1788 9.2886 11.5021 11.6903 13.7356 13.8260 k = 0.4077-0.6966-0.4219 ( 2986 PWs) bands (ev): ************************************-176.0267-176.0252-138.2631-138.2629 -92.7402 -92.7402 -64.3835 -64.3825 -63.5042 -63.5040 -61.5120 -61.5108 -50.6712 -50.6666 -18.9471 -18.9468 -18.0838 -18.0826 -16.9073 -16.8956 -16.5423 -16.5409 -16.0327 -16.0189 -8.9867 -8.6879 -7.7109 -7.3161 -1.2232 -1.1470 3.6317 3.7400 6.2889 6.3308 6.6049 7.0214 9.1674 9.2719 11.4425 11.6308 13.6646 13.7515 k = 0.4154-0.7097-0.4298 ( 2985 PWs) bands (ev): ************************************-176.0250-176.0233-138.2621-138.2599 -92.7398 -92.7398 -64.3841 -64.3832 -63.5048 -63.5046 -61.5118 -61.5107 -50.6788 -50.6740 -18.9478 -18.9475 -18.0771 -18.0759 -16.9078 -16.8971 -16.5440 -16.5427 -16.0257 -16.0131 -8.9562 -8.6860 -7.6250 -7.2618 -1.3395 -1.2651 3.6917 3.7970 6.2619 6.2993 6.6067 6.9983 9.1668 9.2674 11.3856 11.5728 13.6002 13.6827 k = 0.4231-0.7228-0.4378 ( 2989 PWs) bands (ev): ************************************-176.0277-176.0249-138.2656-138.2633 -92.7403 -92.7403 -64.3849 -64.3841 -63.5056 -63.5055 -61.5117 -61.5107 -50.6957 -50.6932 -18.9546 -18.9543 -18.0735 -18.0724 -16.9163 -16.9067 -16.5434 -16.5422 -16.0181 -16.0069 -8.9373 -8.6980 -7.5462 -7.2186 -1.4498 -1.3782 3.7513 3.8519 6.2360 6.2702 6.6051 6.9639 9.1719 9.2696 11.3300 11.5141 13.5374 13.6141 k = 0.4308-0.7360-0.4458 ( 2990 PWs) bands (ev): ************************************-176.0295-176.0268-138.2684-138.2620 -92.7404 -92.7404 -64.3855 -64.3847 -63.5062 -63.5061 -61.5116 -61.5107 -50.7045 -50.7029 -18.9580 -18.9578 -18.0673 -18.0663 -16.9203 -16.9117 -16.5468 -16.5457 -16.0096 -15.9994 -8.9189 -8.7034 -7.4674 -7.1742 -1.5527 -1.4850 3.8101 3.9057 6.2118 6.2435 6.5994 6.9253 9.1839 9.2792 11.2780 11.4565 13.4819 13.5529 k = 0.4385-0.7491-0.4537 ( 2989 PWs) bands (ev): ************************************-176.0291-176.0260-138.2662-138.2602 -92.7400 -92.7400 -64.3859 -64.3852 -63.5066 -63.5065 -61.5115 -61.5107 -50.6887 -50.6852 -18.9613 -18.9611 -18.0590 -18.0582 -16.9225 -16.9149 -16.5461 -16.5452 -16.0034 -15.9945 -8.8961 -8.7067 -7.3918 -7.1306 -1.6473 -1.5839 3.8672 3.9566 6.1903 6.2198 6.5912 6.8831 9.2019 9.2951 11.2300 11.4006 13.4332 13.4978 k = 0.4462-0.7623-0.4617 ( 2995 PWs) bands (ev): ************************************-176.0344-176.0297-138.2743-138.2681 -92.7409 -92.7409 -64.3865 -64.3859 -63.5073 -63.5072 -61.5117 -61.5110 -50.7707 -50.7675 -18.9681 -18.9679 -18.0551 -18.0543 -16.9299 -16.9231 -16.5485 -16.5477 -16.0027 -15.9950 -8.8896 -8.7305 -7.3229 -7.0967 -1.7335 -1.6753 3.9203 4.0021 6.1710 6.1982 6.5804 6.8359 9.2216 9.3129 11.1832 11.3438 13.3850 13.4426 k = 0.4538-0.7754-0.4696 ( 2997 PWs) bands (ev): ************************************-176.0346-176.0337-138.2729-138.2719 -92.7411 -92.7411 -64.3870 -64.3865 -63.5077 -63.5077 -61.5116 -61.5110 -50.8262 -50.8240 -18.9728 -18.9726 -18.0507 -18.0500 -16.9343 -16.9285 -16.5490 -16.5483 -15.9981 -15.9915 -8.8742 -8.7405 -7.2574 -7.0637 -1.8095 -1.7574 3.9703 4.0441 6.1548 6.1795 6.5701 6.7897 9.2465 9.3331 11.1437 11.2905 13.3428 13.3930 k = 0.4615-0.7886-0.4776 ( 2997 PWs) bands (ev): ************************************-176.0369-176.0339-138.2762-138.2707 -92.7410 -92.7410 -64.3873 -64.3869 -63.5081 -63.5080 -61.5115 -61.5110 -50.7952 -50.7921 -18.9748 -18.9746 -18.0460 -18.0454 -16.9355 -16.9307 -16.5511 -16.5506 -15.9930 -15.9876 -8.8621 -8.7518 -7.1977 -7.0362 -1.8740 -1.8291 4.0169 4.0811 6.1414 6.1632 6.5609 6.7444 9.2736 9.3530 11.1111 11.2406 13.3132 13.3550 k = 0.4692-0.8017-0.4856 ( 2997 PWs) bands (ev): ************************************-176.0354-176.0326-138.2743-138.2682 -92.7409 -92.7409 -64.3876 -64.3872 -63.5084 -63.5083 -61.5113 -61.5109 -50.7787 -50.7766 -18.9763 -18.9762 -18.0459 -18.0455 -16.9338 -16.9300 -16.5501 -16.5497 -15.9902 -15.9858 -8.8429 -8.7567 -7.1442 -7.0138 -1.9271 -1.8901 4.0576 4.1110 6.1313 6.1496 6.5547 6.7022 9.3011 9.3702 11.0864 11.1960 13.2878 13.3216 k = 0.4769-0.8148-0.4935 ( 2997 PWs) bands (ev): ************************************-176.0392-176.0338-138.2778-138.2710 -92.7408 -92.7408 -64.3877 -64.3874 -63.5085 -63.5085 -61.5114 -61.5111 -50.7802 -50.7772 -18.9773 -18.9772 -18.0375 -18.0371 -16.9359 -16.9331 -16.5562 -16.5559 -15.9863 -15.9830 -8.8358 -8.7742 -7.0997 -7.0017 -1.9681 -1.9398 4.0920 4.1334 6.1236 6.1379 6.5518 6.6624 9.3272 9.3824 11.0690 11.1543 13.2687 13.2944 k = 0.4846-0.8280-0.5015 ( 3001 PWs) bands (ev): ************************************-176.0382-176.0368-138.2772-138.2765 -92.7415 -92.7415 -64.3880 -64.3878 -63.5088 -63.5088 -61.5114 -61.5112 -50.7955 -50.7942 -18.9789 -18.9789 -18.0432 -18.0430 -16.9368 -16.9349 -16.5567 -16.5565 -15.9866 -15.9845 -8.8296 -8.7880 -7.0629 -6.9977 -1.9964 -1.9771 4.1193 4.1474 6.1191 6.1290 6.5539 6.6277 9.3498 9.3884 11.0606 11.1194 13.2553 13.2724 k = 0.4923-0.8411-0.5094 ( 3008 PWs) bands (ev): ************************************-176.0428-176.0420-138.2840-138.2831 -92.7426 -92.7426 -64.3883 -64.3882 -63.5092 -63.5092 -61.5115 -61.5114 -50.8873 -50.8865 -18.9835 -18.9834 -18.0467 -18.0466 -16.9411 -16.9402 -16.5592 -16.5591 -15.9908 -15.9897 -8.8322 -8.8118 -7.0356 -7.0031 -2.0117 -2.0021 4.1383 4.1524 6.1174 6.1225 6.5614 6.5981 9.3667 9.3867 11.0600 11.0901 13.2456 13.2542 k = 0.5000-0.8543-0.5174 ( 3008 PWs) bands (ev): ************************************-176.0424-176.0424-138.2835-138.2835 -92.7426 -92.7426 -64.3883 -64.3883 -63.5092 -63.5092 -61.5114 -61.5114 -50.8870 -50.8870 -18.9837 -18.9837 -18.0464 -18.0464 -16.9409 -16.9409 -16.5592 -16.5592 -15.9899 -15.9899 -8.8217 -8.8217 -7.0150 -7.0150 -2.0136 -2.0136 4.1497 4.1497 6.1186 6.1186 6.5764 6.5764 9.3799 9.3799 11.0706 11.0706 13.2466 13.2466 k = 0.5000-0.8543-0.5174 ( 3008 PWs) bands (ev): ************************************-176.0424-176.0424-138.2835-138.2835 -92.7426 -92.7426 -64.3883 -64.3883 -63.5092 -63.5092 -61.5114 -61.5114 -50.8870 -50.8870 -18.9837 -18.9837 -18.0464 -18.0464 -16.9409 -16.9409 -16.5592 -16.5592 -15.9899 -15.9899 -8.8217 -8.8217 -7.0150 -7.0150 -2.0136 -2.0136 4.1497 4.1497 6.1186 6.1186 6.5764 6.5764 9.3799 9.3799 11.0706 11.0706 13.2466 13.2466 k = 0.5000-0.8454-0.5320 ( 3008 PWs) bands (ev): ************************************-176.0429-176.0420-138.2837-138.2834 -92.7426 -92.7426 -64.3884 -64.3882 -63.5093 -63.5091 -61.5115 -61.5114 -50.8876 -50.8862 -18.9837 -18.9827 -18.0474 -18.0461 -16.9412 -16.9403 -16.5598 -16.5589 -15.9899 -15.9897 -8.8299 -8.8133 -7.0195 -7.0086 -2.0140 -2.0106 4.1395 4.1574 6.0747 6.1287 6.5719 6.6001 9.3683 9.3940 11.0593 11.0944 13.2464 13.2561 k = 0.5000-0.8366-0.5466 ( 3006 PWs) bands (ev): ************************************-176.0415-176.0396-138.2822-138.2789 -92.7423 -92.7423 -64.3884 -64.3881 -63.5094 -63.5090 -61.5113 -61.5113 -50.8622 -50.8606 -18.9827 -18.9809 -18.0490 -18.0464 -16.9399 -16.9381 -16.5587 -16.5568 -15.9872 -15.9869 -8.8323 -8.7976 -7.0211 -7.0000 -2.0119 -2.0051 4.1270 4.1624 6.0059 6.1025 6.5894 6.6358 9.3599 9.4112 11.0612 11.1303 13.2569 13.2765 k = 0.5000-0.8277-0.5613 ( 2992 PWs) bands (ev): ************************************-176.0320-176.0295-138.2706-138.2661 -92.7399 -92.7399 -64.3881 -64.3876 -63.5091 -63.5086 -61.5109 -61.5108 -50.7362 -50.7352 -18.9750 -18.9723 -18.0421 -18.0382 -16.9348 -16.9320 -16.5465 -16.5438 -15.9796 -15.9791 -8.8121 -8.7616 -7.0182 -6.9855 -2.0060 -1.9956 4.1129 4.1656 5.9215 6.0481 6.6242 6.6779 9.3551 9.4333 11.0781 11.1797 13.2823 13.3111 k = 0.5000-0.8188-0.5759 ( 2992 PWs) bands (ev): ************************************-176.0327-176.0287-138.2703-138.2644 -92.7399 -92.7399 -64.3883 -64.3876 -63.5093 -63.5086 -61.5109 -61.5108 -50.7520 -50.7496 -18.9723 -18.9686 -18.0454 -18.0401 -16.9343 -16.9307 -16.5495 -16.5458 -15.9786 -15.9778 -8.8168 -8.7491 -7.0171 -6.9736 -1.9994 -1.9855 4.0943 4.1631 5.8249 5.9722 6.6638 6.7190 9.3493 9.4553 11.1028 11.2348 13.3100 13.3486 k = 0.5000-0.8100-0.5905 ( 2996 PWs) bands (ev): ************************************-176.0349-176.0306-138.2720-138.2662 -92.7406 -92.7406 -64.3886 -64.3877 -63.5098 -63.5088 -61.5110 -61.5108 -50.7923 -50.7884 -18.9718 -18.9672 -18.0545 -18.0480 -16.9339 -16.9293 -16.5534 -16.5487 -15.9801 -15.9792 -8.8272 -8.7437 -7.0152 -6.9614 -1.9904 -1.9732 4.0722 4.1553 5.7214 5.8826 6.7047 6.7592 9.3448 9.4792 11.1361 11.2956 13.3444 13.3925 k = 0.5000-0.8011-0.6051 ( 2992 PWs) bands (ev): ************************************-176.0313-176.0281-138.2688-138.2651 -92.7399 -92.7399 -64.3885 -64.3875 -63.5098 -63.5086 -61.5110 -61.5108 -50.7767 -50.7685 -18.9640 -18.9585 -18.0545 -18.0467 -16.9328 -16.9273 -16.5552 -16.5496 -15.9786 -15.9775 -8.8267 -8.7295 -7.0102 -6.9450 -1.9775 -1.9568 4.0458 4.1412 5.6156 5.7853 6.7455 6.7997 9.3428 9.5070 11.1785 11.3628 13.3924 13.4496 k = 0.5000-0.7923-0.6198 ( 2990 PWs) bands (ev): ************************************-176.0308-176.0278-138.2679-138.2641 -92.7395 -92.7395 -64.3887 -64.3875 -63.5101 -63.5087 -61.5108 -61.5106 -50.7242 -50.7166 -18.9587 -18.9522 -18.0607 -18.0515 -16.9310 -16.9246 -16.5547 -16.5482 -15.9759 -15.9746 -8.8325 -8.7191 -7.0039 -6.9283 -1.9633 -1.9392 4.0139 4.1180 5.5105 5.6830 6.7836 6.8398 9.3423 9.5368 11.2264 11.4319 13.4503 13.5160 k = 0.5000-0.7834-0.6344 ( 2990 PWs) bands (ev): ************************************-176.0320-176.0280-138.2687-138.2657 -92.7395 -92.7395 -64.3888 -64.3874 -63.5103 -63.5088 -61.5109 -61.5107 -50.7285 -50.7159 -18.9520 -18.9445 -18.0650 -18.0546 -16.9299 -16.9226 -16.5630 -16.5554 -15.9741 -15.9726 -8.8391 -8.7139 -6.9965 -6.9102 -1.9469 -1.9192 3.9745 4.0832 5.4101 5.5789 6.8192 6.8794 9.3423 9.5679 11.2774 11.5009 13.5132 13.5872 k = 0.5000-0.7746-0.6490 ( 2992 PWs) bands (ev): ************************************-176.0352-176.0285-138.2731-138.2678 -92.7398 -92.7398 -64.3891 -64.3875 -63.5108 -63.5090 -61.5109 -61.5106 -50.7236 -50.7117 -18.9449 -18.9364 -18.0778 -18.0660 -16.9311 -16.9230 -16.5640 -16.5555 -15.9742 -15.9726 -8.8516 -8.7121 -6.9873 -6.8924 -1.9279 -1.8968 3.9272 4.0350 5.3178 5.4762 6.8520 6.9191 9.3431 9.6005 11.3295 11.5656 13.5804 13.6611 k = 0.5000-0.7657-0.6636 ( 2994 PWs) bands (ev): ************************************-176.0381-176.0301-138.2774-138.2689 -92.7400 -92.7400 -64.3894 -64.3876 -63.5112 -63.5092 -61.5110 -61.5107 -50.7480 -50.7361 -18.9375 -18.9279 -18.0870 -18.0737 -16.9300 -16.9210 -16.5713 -16.5617 -15.9748 -15.9730 -8.8631 -8.7077 -6.9769 -6.8717 -1.9066 -1.8724 3.8693 3.9702 5.2376 5.3784 6.8835 6.9581 9.3459 9.6337 11.3804 11.6274 13.6333 13.7309 k = 0.5000-0.7568-0.6782 ( 2994 PWs) bands (ev): ************************************-176.0379-176.0305-138.2775-138.2689 -92.7400 -92.7400 -64.3896 -64.3877 -63.5116 -63.5094 -61.5110 -61.5107 -50.7477 -50.7357 -18.9294 -18.9186 -18.0961 -18.0813 -16.9272 -16.9173 -16.5760 -16.5653 -15.9742 -15.9723 -8.8680 -8.6983 -6.9637 -6.8488 -1.8828 -1.8453 3.7993 3.8882 5.1720 5.2883 6.9147 6.9984 9.3500 9.6690 11.4292 11.6837 13.6250 13.7904 k = 0.5000-0.7480-0.6929 ( 2994 PWs) bands (ev): ************************************-176.0377-176.0308-138.2777-138.2690 -92.7399 -92.7399 -64.3898 -64.3877 -63.5120 -63.5097 -61.5110 -61.5106 -50.7474 -50.7351 -18.9204 -18.9085 -18.1057 -18.0896 -16.9242 -16.9133 -16.5810 -16.5692 -15.9735 -15.9714 -8.8725 -8.6890 -6.9488 -6.8246 -1.8565 -1.8159 3.7156 3.7892 5.1217 5.2079 6.9454 7.0389 9.3553 9.7051 11.4740 11.7322 13.5414 13.7646 k = 0.5000-0.7391-0.7075 ( 2998 PWs) bands (ev): ************************************-176.0414-176.0338-138.2815-138.2711 -92.7405 -92.7405 -64.3901 -64.3879 -63.5126 -63.5101 -61.5111 -61.5106 -50.7705 -50.7545 -18.9140 -18.9007 -18.1192 -18.1015 -16.9215 -16.9097 -16.5901 -16.5773 -15.9733 -15.9711 -8.8843 -8.6873 -6.9339 -6.8005 -1.8285 -1.7850 3.6164 3.6755 5.0859 5.1387 6.9755 7.0787 9.3614 9.7413 11.5120 11.7697 13.4141 13.6261 k = 0.5000-0.7303-0.7221 ( 2994 PWs) bands (ev): ************************************-176.0401-176.0311-138.2818-138.2695 -92.7397 -92.7397 -64.3902 -64.3879 -63.5128 -63.5101 -61.5110 -61.5106 -50.7492 -50.7346 -18.8982 -18.8837 -18.1266 -18.1074 -16.9208 -16.9083 -16.5934 -16.5795 -15.9706 -15.9681 -8.8847 -8.6747 -6.9152 -6.7734 -1.7963 -1.7493 3.5004 3.5519 5.0625 5.0835 7.0070 7.1201 9.3692 9.7799 11.5451 11.7974 13.2915 13.4887 k = 0.5000-0.7214-0.7367 ( 2994 PWs) bands (ev): ************************************-176.0399-176.0313-138.2819-138.2696 -92.7396 -92.7396 -64.3904 -64.3879 -63.5132 -63.5104 -61.5110 -61.5106 -50.7488 -50.7339 -18.8876 -18.8717 -18.1381 -18.1173 -16.9172 -16.9037 -16.5993 -16.5842 -15.9696 -15.9670 -8.8883 -8.6661 -6.8957 -6.7454 -1.7630 -1.7131 3.3669 3.4218 5.0313 5.0579 7.0385 7.1620 9.3783 9.8177 11.5690 11.8110 13.1699 13.3534 k = 0.5000-0.7126-0.7514 ( 2996 PWs) bands (ev): ************************************-176.0428-176.0321-138.2864-138.2704 -92.7399 -92.7399 -64.3907 -64.3881 -63.5137 -63.5108 -61.5110 -61.5106 -50.7526 -50.7388 -18.8766 -18.8591 -18.1527 -18.1301 -16.9147 -16.9003 -16.6071 -16.5908 -15.9687 -15.9659 -8.8982 -8.6634 -6.8759 -6.7169 -1.7275 -1.6747 3.2195 3.2858 4.9972 5.0547 7.0700 7.2037 9.3883 9.8551 11.5829 11.8077 13.0574 13.2239 k = 0.5000-0.7037-0.7660 ( 3000 PWs) bands (ev): ************************************-176.0454-176.0339-138.2875-138.2723 -92.7405 -92.7405 -64.3911 -64.3883 -63.5144 -63.5113 -61.5110 -61.5105 -50.7468 -50.7352 -18.8684 -18.8493 -18.1707 -18.1462 -16.9085 -16.8930 -16.6163 -16.5986 -15.9690 -15.9662 -8.9058 -8.6602 -6.8548 -6.6874 -1.6907 -1.6348 3.0630 3.1436 4.9718 5.0608 7.1025 7.2460 9.3990 9.8927 11.5850 11.7839 12.9587 13.1040 k = 0.5000-0.6949-0.7806 ( 2996 PWs) bands (ev): ************************************-176.0433-176.0328-138.2844-138.2713 -92.7397 -92.7397 -64.3912 -64.3883 -63.5147 -63.5114 -61.5110 -61.5105 -50.7122 -50.7019 -18.8532 -18.8326 -18.1787 -18.1524 -16.9040 -16.8875 -16.6223 -16.6032 -15.9656 -15.9627 -8.9043 -8.6480 -6.8307 -6.6556 -1.6500 -1.5913 2.9009 2.9960 4.9548 5.0725 7.1367 7.2904 9.4121 9.9306 11.5756 11.7442 12.8751 12.9998 k = 0.5000-0.6860-0.7952 ( 2998 PWs) bands (ev): ************************************-176.0452-176.0321-138.2875-138.2708 -92.7399 -92.7399 -64.3915 -64.3884 -63.5152 -63.5118 -61.5110 -61.5105 -50.7329 -50.7238 -18.8428 -18.8205 -18.1919 -18.1638 -16.8989 -16.8810 -16.6306 -16.6098 -15.9685 -15.9655 -8.9095 -8.6426 -6.8071 -6.6245 -1.6083 -1.5472 2.7350 2.8435 4.9444 5.0885 7.1714 7.3342 9.4252 9.9651 11.5487 11.6834 12.8040 12.9159 k = 0.5000-0.6771-0.8098 ( 3000 PWs) bands (ev): ************************************-176.0458-176.0330-138.2881-138.2717 -92.7402 -92.7402 -64.3918 -64.3886 -63.5158 -63.5123 -61.5110 -61.5105 -50.7550 -50.7467 -18.8305 -18.8062 -18.2094 -18.1792 -16.8952 -16.8761 -16.6379 -16.6156 -15.9684 -15.9652 -8.9127 -8.6363 -6.7819 -6.5931 -1.5640 -1.5004 2.5673 2.6877 4.9396 5.1079 7.2073 7.3795 9.4393 9.9983 11.5053 11.6069 12.7416 12.8556 k = 0.5000-0.6683-0.8245 ( 2998 PWs) bands (ev): ************************************-176.0442-176.0325-138.2864-138.2712 -92.7397 -92.7397 -64.3920 -64.3887 -63.5162 -63.5125 -61.5109 -61.5104 -50.7422 -50.7355 -18.8170 -18.7907 -18.2203 -18.1879 -16.8904 -16.8700 -16.6442 -16.6203 -15.9663 -15.9630 -8.9122 -8.6267 -6.7556 -6.5608 -1.5173 -1.4512 2.3992 2.5302 4.9401 5.1307 7.2442 7.4260 9.4542 10.0293 11.4446 11.5211 12.6875 12.8196 k = 0.5000-0.6594-0.8391 ( 2998 PWs) bands (ev): ************************************-176.0453-176.0297-138.2849-138.2658 -92.7397 -92.7397 -64.3923 -64.3889 -63.5167 -63.5130 -61.5107 -61.5102 -50.7037 -50.6998 -18.8076 -18.7792 -18.2369 -18.2023 -16.8776 -16.8550 -16.6522 -16.6257 -15.9668 -15.9636 -8.9088 -8.6134 -6.7288 -6.5264 -1.4698 -1.4009 2.2319 2.3720 4.9448 5.1567 7.2827 7.4733 9.4691 10.0576 11.3653 11.4306 12.6435 12.8008 k = 0.5000-0.6506-0.8537 ( 2996 PWs) bands (ev): ************************************-176.0449-176.0279-138.2809-138.2609 -92.7393 -92.7393 -64.3924 -64.3890 -63.5172 -63.5133 -61.5105 -61.5101 -50.7040 -50.6966 -18.7961 -18.7657 -18.2482 -18.2114 -16.8726 -16.8480 -16.6615 -16.6326 -15.9598 -15.9565 -8.9018 -8.5986 -6.7016 -6.4931 -1.4198 -1.3487 2.0660 2.2145 4.9525 5.1830 7.3215 7.5214 9.4846 10.0794 11.2735 11.3391 12.6119 12.7937 k = 0.5000-0.6417-0.8683 ( 2996 PWs) bands (ev): ************************************-176.0435-176.0268-138.2802-138.2609 -92.7392 -92.7392 -64.3927 -64.3891 -63.5176 -63.5136 -61.5105 -61.5100 -50.7066 -50.6983 -18.7832 -18.7502 -18.2633 -18.2238 -16.8707 -16.8450 -16.6653 -16.6351 -15.9585 -15.9551 -8.9012 -8.5910 -6.6744 -6.4618 -1.3681 -1.2948 1.9026 2.0578 4.9625 5.2099 7.3609 7.5694 9.4996 10.0924 11.1789 11.2481 12.5894 12.7941 k = 0.5000-0.6329-0.8829 ( 2996 PWs) bands (ev): ************************************-176.0465-176.0258-138.2824-138.2594 -92.7391 -92.7391 -64.3928 -64.3892 -63.5180 -63.5139 -61.5105 -61.5101 -50.7294 -50.7183 -18.7691 -18.7333 -18.2761 -18.2337 -16.8681 -16.8401 -16.6769 -16.6442 -15.9552 -15.9520 -8.9017 -8.5860 -6.6474 -6.4318 -1.3152 -1.2399 1.7426 1.9036 4.9743 5.2372 7.4010 7.6163 9.5137 10.0949 11.0839 11.1565 12.5750 12.7991 k = 0.5000-0.6240-0.8976 ( 2994 PWs) bands (ev): ************************************-176.0456-176.0253-138.2813-138.2589 -92.7386 -92.7386 -64.3929 -64.3892 -63.5183 -63.5141 -61.5105 -61.5100 -50.7102 -50.6992 -18.7538 -18.7149 -18.2894 -18.2438 -16.8644 -16.8344 -16.6838 -16.6487 -15.9528 -15.9495 -8.9003 -8.5797 -6.6202 -6.4012 -1.2603 -1.1832 1.5870 1.7529 4.9879 5.2646 7.4419 7.6647 9.5267 10.0837 10.9944 11.0751 12.5674 12.8074 k = 0.5000-0.6152-0.9122 ( 2994 PWs) bands (ev): ************************************-176.0470-176.0234-138.2834-138.2560 -92.7385 -92.7385 -64.3931 -64.3893 -63.5187 -63.5145 -61.5104 -61.5100 -50.7111 -50.6996 -18.7414 -18.6991 -18.3049 -18.2559 -16.8606 -16.8283 -16.6897 -16.6522 -15.9521 -15.9488 -8.9003 -8.5747 -6.5940 -6.3714 -1.2047 -1.1260 1.4363 1.6065 5.0022 5.2912 7.4829 7.7132 9.5373 10.0571 10.9054 11.0094 12.5639 12.8166 k = 0.5000-0.6063-0.9268 ( 2996 PWs) bands (ev): ************************************-176.0477-176.0245-138.2842-138.2574 -92.7388 -92.7388 -64.3933 -64.3895 -63.5191 -63.5148 -61.5105 -61.5101 -50.7632 -50.7501 -18.7289 -18.6827 -18.3205 -18.2674 -16.8580 -16.8231 -16.7002 -16.6597 -15.9532 -15.9499 -8.9013 -8.5729 -6.5689 -6.3442 -1.1485 -1.0685 1.2917 1.4653 5.0170 5.3168 7.5241 7.7603 9.5447 10.0139 10.8163 10.9641 12.5637 12.8263 k = 0.5000-0.5974-0.9414 ( 2992 PWs) bands (ev): ************************************-176.0449-176.0220-138.2817-138.2553 -92.7380 -92.7380 -64.3933 -64.3894 -63.5193 -63.5149 -61.5105 -61.5101 -50.7450 -50.7292 -18.7128 -18.6622 -18.3329 -18.2752 -16.8543 -16.8174 -16.7040 -16.6614 -15.9511 -15.9478 -8.8953 -8.5635 -6.5440 -6.3170 -1.0907 -1.0093 1.1544 1.3307 5.0322 5.3422 7.5654 7.8077 9.5485 9.9585 10.7342 10.9415 12.5662 12.8358 k = 0.5000-0.5886-0.9561 ( 2988 PWs) bands (ev): ************************************-176.0416-176.0180-138.2773-138.2494 -92.7372 -92.7372 -64.3934 -64.3894 -63.5195 -63.5150 -61.5103 -61.5099 -50.7096 -50.6929 -18.7009 -18.6459 -18.3451 -18.2829 -16.8481 -16.8086 -16.7072 -16.6618 -15.9482 -15.9449 -8.8834 -8.5489 -6.5209 -6.2916 -1.0342 -0.9517 1.0253 1.2040 5.0469 5.3654 7.6070 7.8539 9.5471 9.8938 10.6591 10.9371 12.5711 12.8449 k = 0.5000-0.5797-0.9707 ( 2986 PWs) bands (ev): ************************************-176.0409-176.0167-138.2767-138.2486 -92.7368 -92.7368 -64.3934 -64.3893 -63.5196 -63.5151 -61.5103 -61.5100 -50.7219 -50.7031 -18.6877 -18.6279 -18.3556 -18.2885 -16.8468 -16.8044 -16.7152 -16.6665 -15.9459 -15.9427 -8.8795 -8.5443 -6.4998 -6.2698 -0.9790 -0.8963 0.9056 1.0857 5.0604 5.3848 7.6475 7.8973 9.5393 9.8237 10.5926 10.9442 12.5757 12.8519 k = 0.5000-0.5709-0.9853 ( 2990 PWs) bands (ev): ************************************-176.0422-176.0186-138.2782-138.2510 -92.7375 -92.7375 -64.3936 -64.3895 -63.5201 -63.5155 -61.5103 -61.5100 -50.7532 -50.7349 -18.6817 -18.6164 -18.3742 -18.3016 -16.8459 -16.8010 -16.7208 -16.6695 -15.9468 -15.9437 -8.8829 -8.5471 -6.4815 -6.2523 -0.9262 -0.8438 0.7967 0.9772 5.0721 5.4004 7.6871 7.9380 9.5242 9.7537 10.5376 10.9589 12.5784 12.8561 k = 0.5000-0.5620-0.9999 ( 2996 PWs) bands (ev): ************************************-176.0463-176.0228-138.2831-138.2559 -92.7385 -92.7385 -64.3940 -64.3898 -63.5206 -63.5160 -61.5104 -61.5101 -50.7930 -50.7767 -18.6777 -18.6067 -18.3926 -18.3143 -16.8480 -16.8012 -16.7270 -16.6737 -15.9475 -15.9445 -8.8934 -8.5588 -6.4659 -6.2394 -0.8771 -0.7957 0.7002 0.8796 5.0814 5.4117 7.7254 7.9748 9.5024 9.6879 10.4956 10.9798 12.5800 12.8584 k = 0.5000-0.5532-1.0145 ( 2988 PWs) bands (ev): ************************************-176.0432-176.0185-138.2788-138.2516 -92.7370 -92.7370 -64.3937 -64.3896 -63.5204 -63.5158 -61.5103 -61.5100 -50.7386 -50.7188 -18.6634 -18.5870 -18.3964 -18.3128 -16.8468 -16.7988 -16.7281 -16.6734 -15.9418 -15.9389 -8.8815 -8.5475 -6.4513 -6.2261 -0.8304 -0.7503 0.6189 0.7975 5.0890 5.4202 7.7630 8.0114 9.4761 9.6311 10.4691 11.0083 12.5832 12.8597 k = 0.5000-0.5443-1.0292 ( 2986 PWs) bands (ev): ************************************-176.0430-176.0174-138.2771-138.2504 -92.7366 -92.7366 -64.3936 -64.3895 -63.5205 -63.5158 -61.5103 -61.5101 -50.7278 -50.7066 -18.6548 -18.5728 -18.4050 -18.3157 -16.8483 -16.7996 -16.7303 -16.6750 -15.9383 -15.9356 -8.8759 -8.5442 -6.4412 -6.2179 -0.7909 -0.7132 0.5541 0.7311 5.0932 5.4224 7.7988 8.0431 9.4465 9.5827 10.4538 11.0381 12.5841 12.8581 k = 0.5000-0.5354-1.0438 ( 2988 PWs) bands (ev): ************************************-176.0435-176.0210-138.2769-138.2548 -92.7370 -92.7370 -64.3936 -64.3895 -63.5206 -63.5160 -61.5104 -61.5102 -50.7292 -50.7103 -18.6497 -18.5622 -18.4146 -18.3199 -16.8525 -16.8042 -16.7340 -16.6788 -15.9364 -15.9339 -8.8802 -8.5518 -6.4354 -6.2156 -0.7586 -0.6842 0.5075 0.6819 5.0939 5.4176 7.8324 8.0688 9.4176 9.5418 10.4488 11.0685 12.5831 12.8537 k = 0.5000-0.5266-1.0584 ( 2990 PWs) bands (ev): ************************************-176.0486-176.0229-138.2836-138.2559 -92.7373 -92.7373 -64.3936 -64.3894 -63.5207 -63.5160 -61.5107 -61.5105 -50.7513 -50.7294 -18.6452 -18.5535 -18.4204 -18.3215 -16.8574 -16.8098 -16.7371 -16.6826 -15.9370 -15.9347 -8.8874 -8.5611 -6.4338 -6.2192 -0.7345 -0.6641 0.4805 0.6513 5.0901 5.4064 7.8638 8.0906 9.3935 9.5093 10.4534 11.0988 12.5803 12.8469 k = 0.5000-0.5177-1.0730 ( 2992 PWs) bands (ev): ************************************-176.0488-176.0239-138.2838-138.2582 -92.7376 -92.7376 -64.3936 -64.3895 -63.5208 -63.5162 -61.5107 -61.5105 -50.7685 -50.7487 -18.6456 -18.5516 -18.4262 -18.3250 -16.8586 -16.8126 -16.7345 -16.6815 -15.9379 -15.9358 -8.8880 -8.5648 -6.4364 -6.2256 -0.7189 -0.6530 0.4736 0.6407 5.0821 5.3891 7.8935 8.1090 9.3774 9.4852 10.4662 11.1302 12.5754 12.8378 k = 0.5000-0.5089-1.0877 ( 2990 PWs) bands (ev): ************************************-176.0457-176.0201-138.2813-138.2561 -92.7373 -92.7373 -64.3935 -64.3894 -63.5209 -63.5162 -61.5105 -61.5103 -50.7331 -50.7098 -18.6460 -18.5515 -18.4278 -18.3261 -16.8549 -16.8097 -16.7286 -16.6766 -15.9388 -15.9370 -8.8806 -8.5593 -6.4437 -6.2363 -0.7108 -0.6492 0.4863 0.6499 5.0693 5.3656 7.9217 8.1253 9.3713 9.4701 10.4876 11.1635 12.5695 12.8267 k = 0.5000-0.5000-1.1023 ( 2992 PWs) bands (ev): ************************************-176.0458-176.0211-138.2814-138.2584 -92.7377 -92.7377 -64.3935 -64.3894 -63.5209 -63.5163 -61.5106 -61.5103 -50.7496 -50.7283 -18.6487 -18.5557 -18.4279 -18.3277 -16.8566 -16.8135 -16.7245 -16.6746 -15.9402 -15.9386 -8.8812 -8.5641 -6.4566 -6.2533 -0.7092 -0.6519 0.5166 0.6766 5.0509 5.3337 7.9480 8.1377 9.3738 9.4632 10.5122 11.1928 12.5609 12.8134 k = 0.5000-0.4912-1.1169 ( 2994 PWs) bands (ev): ************************************-176.0466-176.0212-138.2834-138.2605 -92.7381 -92.7381 -64.3935 -64.3894 -63.5210 -63.5164 -61.5106 -61.5103 -50.7599 -50.7377 -18.6524 -18.5615 -18.4278 -18.3298 -16.8575 -16.8163 -16.7190 -16.6711 -15.9426 -15.9414 -8.8846 -8.5716 -6.4749 -6.2752 -0.7120 -0.6587 0.5625 0.7195 5.0270 5.2938 7.9730 8.1493 9.3849 9.4651 10.5419 11.2210 12.5501 12.7981 k = 0.8166-0.4053-0.9527 ( 2994 PWs) bands (ev): ************************************-176.0446-176.0376-138.2838-138.2716 -92.7382 -92.7382 -64.3933 -64.3892 -63.5210 -63.5164 -61.5106 -61.5103 -50.7521 -50.7201 -18.6648 -18.5869 -18.4038 -18.3187 -16.8488 -16.7970 -16.7394 -16.6808 -15.9442 -15.9428 -8.8928 -8.5928 -6.4726 -6.2575 -0.7665 -0.6825 0.5982 0.7325 5.0500 5.4074 7.7289 8.1687 9.3462 9.6283 10.6976 10.9132 12.6496 12.9363 k = 0.8121-0.3976-0.9379 ( 2994 PWs) bands (ev): ************************************-176.0447-176.0377-138.2842-138.2711 -92.7382 -92.7382 -64.3931 -64.3890 -63.5209 -63.5163 -61.5106 -61.5103 -50.7516 -50.7198 -18.6704 -18.5972 -18.3946 -18.3142 -16.8488 -16.7983 -16.7372 -16.6802 -15.9449 -15.9438 -8.8935 -8.5944 -6.4967 -6.2793 -0.7772 -0.6968 0.6657 0.7983 5.0111 5.3618 7.7545 8.1625 9.3464 9.6705 10.7310 10.9687 12.6284 12.9101 k = 0.8075-0.3899-0.9231 ( 2990 PWs) bands (ev): ************************************-176.0423-176.0332-138.2782-138.2736 -92.7376 -92.7376 -64.3927 -64.3886 -63.5205 -63.5159 -61.5106 -61.5103 -50.7454 -50.7197 -18.6739 -18.6057 -18.3800 -18.3047 -16.8471 -16.7994 -16.7302 -16.6762 -15.9464 -15.9456 -8.8909 -8.5907 -6.5267 -6.3050 -0.7854 -0.7092 0.7435 0.8755 4.9667 5.3094 7.7813 8.1601 9.3536 9.7195 10.7661 11.0252 12.6066 12.8827 k = 0.8030-0.3821-0.9083 ( 2988 PWs) bands (ev): ************************************-176.0426-176.0295-138.2770-138.2688 -92.7373 -92.7373 -64.3923 -64.3883 -63.5203 -63.5157 -61.5106 -61.5102 -50.6526 -50.6328 -18.6790 -18.6146 -18.3715 -18.3001 -16.8455 -16.7991 -16.7253 -16.6728 -15.9466 -15.9457 -8.8882 -8.5837 -6.5631 -6.3367 -0.7903 -0.7185 0.8299 0.9618 4.9158 5.2502 7.8101 8.1635 9.3677 9.7734 10.8024 11.0822 12.5838 12.8535 k = 0.7985-0.3744-0.8936 ( 2992 PWs) bands (ev): ************************************-176.0452-176.0316-138.2787-138.2728 -92.7381 -92.7381 -64.3922 -64.3881 -63.5202 -63.5157 -61.5107 -61.5102 -50.6916 -50.6654 -18.6921 -18.6329 -18.3617 -18.2954 -16.8478 -16.8043 -16.7210 -16.6718 -15.9501 -15.9491 -8.8947 -8.5957 -6.6070 -6.3746 -0.7907 -0.7235 0.9232 1.0554 4.8586 5.1826 7.8390 8.1693 9.3862 9.8288 10.8380 11.1376 12.5600 12.8228 k = 0.7940-0.3667-0.8788 ( 2996 PWs) bands (ev): ************************************-176.0471-176.0318-138.2820-138.2749 -92.7389 -92.7389 -64.3920 -64.3880 -63.5201 -63.5156 -61.5108 -61.5103 -50.7452 -50.7198 -18.7016 -18.6454 -18.3578 -18.2946 -16.8509 -16.8106 -16.7150 -16.6693 -15.9547 -15.9533 -8.9037 -8.6066 -6.6570 -6.4182 -0.7848 -0.7225 1.0224 1.1554 4.7955 5.1086 7.8693 8.1795 9.4096 9.8857 10.8751 11.1921 12.5366 12.7914 k = 0.7895-0.3590-0.8640 ( 2998 PWs) bands (ev): ************************************-176.0495-176.0317-138.2830-138.2754 -92.7394 -92.7394 -64.3917 -64.3877 -63.5199 -63.5155 -61.5108 -61.5102 -50.7320 -50.7101 -18.7128 -18.6601 -18.3514 -18.2918 -16.8505 -16.8123 -16.7084 -16.6652 -15.9593 -15.9573 -8.9111 -8.6122 -6.7129 -6.4651 -0.7723 -0.7146 1.1271 1.2612 4.7281 5.0304 7.9021 8.1963 9.4384 9.9435 10.9139 11.2478 12.5137 12.7596 k = 0.7849-0.3512-0.8492 ( 2998 PWs) bands (ev): ************************************-176.0498-176.0313-138.2828-138.2748 -92.7395 -92.7395 -64.3912 -64.3873 -63.5194 -63.5151 -61.5109 -61.5102 -50.7081 -50.6882 -18.7184 -18.6679 -18.3462 -18.2890 -16.8517 -16.8155 -16.7024 -16.6615 -15.9624 -15.9600 -8.9132 -8.6131 -6.7745 -6.5168 -0.7528 -0.6990 1.2366 1.3721 4.6565 4.9481 7.9366 8.2174 9.4713 10.0015 10.9549 11.3037 12.4917 12.7276 k = 0.7804-0.3435-0.8344 ( 2996 PWs) bands (ev): ************************************-176.0482-176.0308-138.2823-138.2715 -92.7393 -92.7393 -64.3907 -64.3868 -63.5189 -63.5146 -61.5110 -61.5103 -50.6834 -50.6675 -18.7250 -18.6776 -18.3357 -18.2816 -16.8518 -16.8172 -16.6963 -16.6574 -15.9651 -15.9621 -8.9129 -8.6116 -6.8413 -6.5704 -0.7268 -0.6757 1.3501 1.4875 4.5817 4.8626 7.9726 8.2426 9.5072 10.0576 10.9982 11.3593 12.4709 12.6960 k = 0.7759-0.3358-0.8196 ( 2994 PWs) bands (ev): ************************************-176.0480-176.0272-138.2818-138.2721 -92.7391 -92.7391 -64.3900 -64.3862 -63.5182 -63.5140 -61.5111 -61.5103 -50.7079 -50.6915 -18.7301 -18.6850 -18.3273 -18.2754 -16.8518 -16.8193 -16.6891 -16.6527 -15.9696 -15.9658 -8.9170 -8.6113 -6.9136 -6.6291 -0.6941 -0.6444 1.4671 1.6062 4.5037 4.7740 8.0095 8.2709 9.5449 10.1117 11.0439 11.4141 12.4515 12.6649 k = 0.7714-0.3281-0.8049 ( 2990 PWs) bands (ev): ************************************-176.0442-176.0231-138.2773-138.2690 -92.7386 -92.7386 -64.3894 -64.3856 -63.5175 -63.5134 -61.5111 -61.5102 -50.6566 -50.6410 -18.7342 -18.6910 -18.3200 -18.2703 -16.8499 -16.8184 -16.6828 -16.6480 -15.9698 -15.9653 -8.9152 -8.6041 -6.9900 -6.6881 -0.6558 -0.6056 1.5874 1.7284 4.4243 4.6854 8.0485 8.3028 9.5846 10.1633 11.0931 11.4691 12.4343 12.6354 k = 0.7668-0.3203-0.7901 ( 2988 PWs) bands (ev): ************************************-176.0428-176.0218-138.2743-138.2652 -92.7385 -92.7385 -64.3887 -64.3851 -63.5168 -63.5128 -61.5110 -61.5101 -50.6039 -50.5888 -18.7406 -18.6995 -18.3143 -18.2668 -16.8490 -16.8187 -16.6746 -16.6417 -15.9726 -15.9675 -8.9195 -8.5990 -7.0708 -6.7501 -0.6120 -0.5596 1.7101 1.8532 4.3435 4.5958 8.0877 8.3365 9.6243 10.2111 11.1457 11.5232 12.4188 12.6072 k = 0.7623-0.3126-0.7753 ( 2988 PWs) bands (ev): ************************************-176.0432-176.0203-138.2752-138.2636 -92.7387 -92.7387 -64.3881 -64.3845 -63.5162 -63.5122 -61.5112 -61.5101 -50.6210 -50.6064 -18.7474 -18.7084 -18.3087 -18.2635 -16.8518 -16.8230 -16.6656 -16.6349 -15.9784 -15.9725 -8.9311 -8.6011 -7.1550 -6.8146 -0.5632 -0.5068 1.8349 1.9802 4.2610 4.5050 8.1266 8.3707 9.6633 10.2549 11.2019 11.5763 12.4047 12.5805 k = 0.7578-0.3049-0.7605 ( 2986 PWs) bands (ev): ************************************-176.0411-176.0183-138.2727-138.2606 -92.7385 -92.7385 -64.3873 -64.3838 -63.5154 -63.5115 -61.5112 -61.5101 -50.5866 -50.5746 -18.7532 -18.7160 -18.3037 -18.2603 -16.8477 -16.8193 -16.6584 -16.6287 -15.9854 -15.9786 -8.9364 -8.5948 -7.2422 -6.8795 -0.5095 -0.4478 1.9616 2.1096 4.1795 4.4162 8.1656 8.4063 9.7014 10.2955 11.2618 11.6295 12.3944 12.5575 k = 0.7533-0.2972-0.7457 ( 2986 PWs) bands (ev): ************************************-176.0410-176.0172-138.2728-138.2585 -92.7387 -92.7387 -64.3866 -64.3831 -63.5146 -63.5108 -61.5113 -61.5101 -50.5391 -50.5283 -18.7592 -18.7234 -18.3028 -18.2610 -16.8442 -16.8163 -16.6518 -16.6233 -15.9933 -15.9855 -8.9483 -8.5924 -7.3320 -6.9453 -0.4510 -0.3831 2.0893 2.2397 4.1008 4.3302 8.2040 8.4420 9.7374 10.3325 11.3248 11.6807 12.3861 12.5373 k = 0.7487-0.2894-0.7309 ( 2988 PWs) bands (ev): ************************************-176.0413-176.0192-138.2730-138.2620 -92.7392 -92.7392 -64.3859 -64.3825 -63.5139 -63.5101 -61.5115 -61.5102 -50.5602 -50.5487 -18.7656 -18.7312 -18.3015 -18.2613 -16.8458 -16.8188 -16.6462 -16.6194 -16.0010 -15.9924 -8.9655 -8.6031 -7.4238 -7.0124 -0.3885 -0.3139 2.2173 2.3697 4.0238 4.2462 8.2407 8.4768 9.7707 10.3656 11.3902 11.7294 12.3811 12.5211 k = 0.7442-0.2817-0.7162 ( 2992 PWs) bands (ev): ************************************-176.0460-176.0203-138.2760-138.2658 -92.7402 -92.7402 -64.3853 -64.3819 -63.5131 -63.5095 -61.5117 -61.5103 -50.6125 -50.5978 -18.7748 -18.7421 -18.3007 -18.2623 -16.8487 -16.8221 -16.6409 -16.6156 -16.0100 -16.0005 -8.9914 -8.6166 -7.5169 -7.0807 -0.3226 -0.2412 2.3442 2.4988 3.9503 4.1659 8.2747 8.5098 9.8005 10.3956 11.4573 11.7764 12.3795 12.5093 k = 0.7397-0.2740-0.7014 ( 2996 PWs) bands (ev): ************************************-176.0491-176.0214-138.2788-138.2693 -92.7411 -92.7411 -64.3845 -64.3812 -63.5124 -63.5089 -61.5119 -61.5105 -50.6704 -50.6588 -18.7776 -18.7455 -18.3073 -18.2697 -16.8526 -16.8267 -16.6326 -16.6092 -16.0219 -16.0113 -9.0213 -8.6304 -7.6107 -7.1484 -0.2528 -0.1643 2.4692 2.6253 3.8842 4.0917 8.3063 8.5421 9.8267 10.4233 11.5250 11.8222 12.3831 12.5045 k = 0.7352-0.2662-0.6866 ( 2990 PWs) bands (ev): ************************************-176.0462-176.0191-138.2752-138.2667 -92.7403 -92.7403 -64.3834 -64.3802 -63.5111 -63.5077 -61.5120 -61.5105 -50.6487 -50.6390 -18.7807 -18.7503 -18.2985 -18.2628 -16.8503 -16.8246 -16.6223 -16.6003 -16.0277 -16.0160 -9.0412 -8.6291 -7.7019 -7.2077 -0.1800 -0.0839 2.5900 2.7469 3.8306 4.0297 8.3354 8.5748 9.8492 10.4503 11.5936 11.8690 12.3930 12.5075 k = 0.7307-0.2585-0.6718 ( 2984 PWs) bands (ev): ************************************-176.0417-176.0137-138.2707-138.2623 -92.7396 -92.7396 -64.3823 -64.3792 -63.5099 -63.5066 -61.5119 -61.5103 -50.5734 -50.5669 -18.7774 -18.7477 -18.2996 -18.2646 -16.8452 -16.8193 -16.6153 -16.5942 -16.0321 -16.0191 -9.0619 -8.6267 -7.7907 -7.2633 -0.1050 -0.0013 2.7037 2.8597 3.7935 3.9814 8.3614 8.6066 9.8674 10.4754 11.6606 11.9130 12.4100 12.5196 k = 0.7261-0.2508-0.6570 ( 2988 PWs) bands (ev): ************************************-176.0437-176.0169-138.2742-138.2666 -92.7406 -92.7406 -64.3814 -64.3783 -63.5089 -63.5057 -61.5122 -61.5106 -50.6358 -50.6303 -18.7832 -18.7546 -18.3004 -18.2668 -16.8481 -16.8222 -16.6130 -16.5930 -16.0433 -16.0292 -9.1016 -8.6461 -7.8796 -7.3238 -0.0301 0.0805 2.8053 2.9555 3.7765 3.9467 8.3813 8.6344 9.8805 10.4960 11.7237 11.9514 12.4324 12.5404 k = 0.7216-0.2431-0.6422 ( 2988 PWs) bands (ev): ************************************-176.0435-176.0167-138.2742-138.2666 -92.7409 -92.7409 -64.3804 -64.3774 -63.5078 -63.5047 -61.5124 -61.5107 -50.6371 -50.6314 -18.7863 -18.7588 -18.3015 -18.2691 -16.8458 -16.8194 -16.6074 -16.5884 -16.0546 -16.0392 -9.1374 -8.6613 -7.9628 -7.3781 0.0454 0.1629 2.8902 3.0301 3.7917 3.9361 8.3972 8.6616 9.8893 10.5147 11.7838 11.9889 12.4640 12.5726 k = 0.7171-0.2353-0.6275 ( 2992 PWs) bands (ev): ************************************-176.0460-176.0193-138.2777-138.2699 -92.7419 -92.7419 -64.3795 -64.3766 -63.5068 -63.5038 -61.5127 -61.5109 -50.7030 -50.6946 -18.7907 -18.7640 -18.3071 -18.2758 -16.8469 -16.8202 -16.6021 -16.5842 -16.0686 -16.0519 -9.1837 -8.6899 -8.0413 -7.4336 0.1198 0.2435 2.9524 3.0789 3.8407 3.9517 8.4074 8.6858 9.8936 10.5281 11.8396 12.0232 12.5037 12.6149 k = 0.7126-0.2276-0.6127 ( 2988 PWs) bands (ev): ************************************-176.0428-176.0170-138.2749-138.2649 -92.7415 -92.7415 -64.3783 -64.3754 -63.5054 -63.5026 -61.5128 -61.5110 -50.6572 -50.6489 -18.7922 -18.7668 -18.3039 -18.2739 -16.8405 -16.8131 -16.5966 -16.5794 -16.0791 -16.0609 -9.2198 -8.7105 -8.1083 -7.4757 0.1929 0.3229 2.9911 3.1084 3.9239 4.0009 8.4139 8.7097 9.8942 10.5402 11.8923 12.0575 12.5536 12.6687 k = 0.7080-0.2199-0.5979 ( 2982 PWs) bands (ev): ************************************-176.0386-176.0136-138.2711-138.2575 -92.7408 -92.7408 -64.3770 -64.3742 -63.5039 -63.5012 -61.5129 -61.5110 -50.5825 -50.5749 -18.7922 -18.7679 -18.2999 -18.2712 -16.8322 -16.8039 -16.5909 -16.5742 -16.0895 -16.0699 -9.2570 -8.7379 -8.1612 -7.5115 0.2632 0.3990 3.0094 3.1246 4.0318 4.0822 8.4160 8.7318 9.8907 10.5480 11.9422 12.0911 12.6124 12.7318 k = 0.7035-0.2122-0.5831 ( 2984 PWs) bands (ev): ************************************-176.0395-176.0144-138.2721-138.2574 -92.7415 -92.7415 -64.3759 -64.3732 -63.5027 -63.5001 -61.5131 -61.5112 -50.6018 -50.5937 -18.7958 -18.7723 -18.3048 -18.2772 -16.8288 -16.7997 -16.5872 -16.5713 -16.1035 -16.0823 -9.3082 -8.7875 -8.2075 -7.5517 0.3287 0.4687 3.0142 3.1317 4.1508 4.1900 8.4121 8.7493 9.8827 10.5487 11.9897 12.1234 12.6786 12.8021 k = 0.6990-0.2044-0.5683 ( 2980 PWs) bands (ev): ************************************-176.0353-176.0113-138.2685-138.2538 -92.7412 -92.7412 -64.3746 -64.3720 -63.5012 -63.4987 -61.5132 -61.5112 -50.5564 -50.5454 -18.7962 -18.7737 -18.3052 -18.2787 -16.8210 -16.7908 -16.5820 -16.5667 -16.1146 -16.0919 -9.3561 -8.8409 -8.2355 -7.5826 0.3895 0.5330 3.0164 3.1375 4.2781 4.3212 8.4048 8.7652 9.8717 10.5451 12.0375 12.1573 12.7531 12.8802 k = 0.6945-0.1967-0.5536 ( 2984 PWs) bands (ev): ************************************-176.0374-176.0140-138.2734-138.2546 -92.7423 -92.7423 -64.3736 -64.3710 -63.5000 -63.4977 -61.5135 -61.5115 -50.5865 -50.5780 -18.8004 -18.7788 -18.3106 -18.2852 -16.8197 -16.7884 -16.5800 -16.5653 -16.1307 -16.1065 -9.4147 -8.9128 -8.2646 -7.6201 0.4430 0.5880 3.0197 3.1429 4.4130 4.4653 8.3928 8.7761 9.8562 10.5336 12.0845 12.1905 12.8325 12.9619 k = 0.6900-0.1890-0.5388 ( 2984 PWs) bands (ev): ************************************-176.0347-176.0140-138.2705-138.2548 -92.7427 -92.7427 -64.3724 -64.3699 -63.4987 -63.4964 -61.5136 -61.5115 -50.5557 -50.5460 -18.8025 -18.7817 -18.3157 -18.2913 -16.8137 -16.7811 -16.5769 -16.5627 -16.1434 -16.1175 -9.4725 -8.9852 -8.2796 -7.6466 0.4893 0.6346 3.0318 3.1558 4.5563 4.6176 8.3781 8.7855 9.8381 10.5174 12.1334 12.2263 12.9189 13.0491 k = 0.6854-0.1812-0.5240 ( 2986 PWs) bands (ev): ************************************-176.0361-176.0169-138.2710-138.2577 -92.7434 -92.7434 -64.3712 -64.3687 -63.4973 -63.4952 -61.5139 -61.5118 -50.5946 -50.5823 -18.8025 -18.7823 -18.3223 -18.2987 -16.8123 -16.7786 -16.5721 -16.5589 -16.1603 -16.1327 -9.5356 -9.0652 -8.2931 -7.6759 0.5273 0.6710 3.0528 3.1750 4.7049 4.7739 8.3598 8.7902 9.8164 10.4945 12.1840 12.2636 13.0095 13.1389 k = 0.6809-0.1735-0.5092 ( 2994 PWs) bands (ev): ************************************-176.0400-176.0237-138.2771-138.2647 -92.7451 -92.7451 -64.3702 -64.3678 -63.4962 -63.4941 -61.5144 -61.5123 -50.6958 -50.6843 -18.8040 -18.7843 -18.3349 -18.3120 -16.8159 -16.7811 -16.5719 -16.5595 -16.1778 -16.1487 -9.6037 -9.1516 -8.3122 -7.7114 0.5551 0.6951 3.0842 3.2027 4.8572 4.9327 8.3383 8.7898 9.7914 10.4648 12.2355 12.3017 13.1040 13.2311 k = 0.6764-0.1658-0.4944 ( 2992 PWs) bands (ev): ************************************-176.0376-176.0207-138.2777-138.2602 -92.7452 -92.7452 -64.3689 -64.3666 -63.4947 -63.4928 -61.5144 -61.5123 -50.6783 -50.6644 -18.8036 -18.7846 -18.3424 -18.3203 -16.8048 -16.7679 -16.5663 -16.5543 -16.1947 -16.1634 -9.6641 -9.2339 -8.3084 -7.7274 0.5743 0.7095 3.1310 3.2442 5.0146 5.0957 8.3164 8.7892 9.7654 10.4340 12.2893 12.3430 13.2032 13.3268 k = 0.6719-0.1581-0.4796 ( 2994 PWs) bands (ev): ************************************-176.0395-176.0224-138.2786-138.2630 -92.7460 -92.7460 -64.3677 -64.3654 -63.4933 -63.4915 -61.5147 -61.5125 -50.7126 -50.6996 -18.8044 -18.7861 -18.3501 -18.3289 -16.8016 -16.7630 -16.5632 -16.5518 -16.2113 -16.1782 -9.7295 -9.3190 -8.3114 -7.7503 0.5838 0.7127 3.1907 3.2969 5.1743 5.2600 8.2917 8.7839 9.7361 10.3964 12.3434 12.3847 13.3047 13.4233 k = 0.6673-0.1503-0.4649 ( 2994 PWs) bands (ev): ************************************-176.0393-176.0218-138.2788-138.2625 -92.7464 -92.7464 -64.3664 -64.3642 -63.4919 -63.4902 -61.5149 -61.5127 -50.7145 -50.7011 -18.8028 -18.7851 -18.3579 -18.3374 -16.7961 -16.7554 -16.5590 -16.5482 -16.2279 -16.1928 -9.7939 -9.4035 -8.3075 -7.7656 0.5843 0.7062 3.2637 3.3624 5.3363 5.4258 8.2664 8.7765 9.7054 10.3564 12.3978 12.4277 13.4094 13.5215 k = 0.6628-0.1426-0.4501 ( 2998 PWs) bands (ev): ************************************-176.0421-176.0261-138.2831-138.2705 -92.7474 -92.7474 -64.3652 -64.3630 -63.4904 -63.4888 -61.5153 -61.5131 -50.7957 -50.7825 -18.8010 -18.7839 -18.3666 -18.3469 -16.7921 -16.7492 -16.5596 -16.5498 -16.2500 -16.2124 -9.8625 -9.4892 -8.3128 -7.7908 0.5756 0.6899 3.3476 3.4379 5.4986 5.5913 8.2385 8.7638 9.6726 10.3116 12.4508 12.4706 13.5158 13.6201 k = 0.6583-0.1349-0.4353 ( 3000 PWs) bands (ev): ************************************-176.0461-176.0269-138.2842-138.2709 -92.7481 -92.7481 -64.3640 -64.3618 -63.4890 -63.4875 -61.5155 -61.5133 -50.7924 -50.7808 -18.8083 -18.7923 -18.3695 -18.3510 -16.7854 -16.7399 -16.5579 -16.5483 -16.2671 -16.2272 -9.9276 -9.5729 -8.3088 -7.8043 0.5594 0.6657 3.4427 3.5245 5.6625 5.7580 8.2115 8.7507 9.6388 10.2651 12.5017 12.5135 13.6245 13.7203 k = 0.6538-0.1272-0.4205 ( 2998 PWs) bands (ev): ************************************-176.0430-176.0241-138.2811-138.2702 -92.7482 -92.7482 -64.3627 -64.3605 -63.4875 -63.4861 -61.5156 -61.5134 -50.7590 -50.7463 -18.8045 -18.7891 -18.3788 -18.3610 -16.7769 -16.7284 -16.5520 -16.5425 -16.2845 -16.2421 -9.9898 -9.6540 -8.2947 -7.8121 0.5363 0.6349 3.5493 3.6233 5.8272 5.9251 8.1856 8.7365 9.6049 10.2182 12.5496 12.5582 13.7355 13.8220 k = 0.6492-0.1194-0.4057 ( 2994 PWs) bands (ev): ************************************-176.0397-176.0193-138.2747-138.2652 -92.7479 -92.7479 -64.3612 -64.3591 -63.4859 -63.4845 -61.5157 -61.5134 -50.6983 -50.6886 -18.7987 -18.7837 -18.3876 -18.3704 -16.7699 -16.7188 -16.5446 -16.5347 -16.2983 -16.2540 -10.0512 -9.7334 -8.2725 -7.8091 0.5088 0.6001 3.6651 3.7319 5.9918 6.0919 8.1598 8.7214 9.5710 10.1715 12.5926 12.6033 13.8475 13.9264 k = 0.6447-0.1117-0.3909 ( 2996 PWs) bands (ev): ************************************-176.0403-176.0196-138.2720-138.2668 -92.7487 -92.7487 -64.3601 -64.3580 -63.4845 -63.4833 -61.5158 -61.5136 -50.6862 -50.6780 -18.7969 -18.7823 -18.4024 -18.3857 -16.7658 -16.7117 -16.5396 -16.5287 -16.3149 -16.2686 -10.1160 -9.8132 -8.2614 -7.8189 0.4749 0.5593 3.7875 3.8472 6.1553 6.2573 8.1339 8.7021 9.5355 10.1207 12.6312 12.6451 13.9589 14.0299 k = 0.6402-0.1040-0.3762 ( 2992 PWs) bands (ev): ************************************-176.0365-176.0177-138.2665-138.2635 -92.7484 -92.7484 -64.3587 -64.3567 -63.4829 -63.4818 -61.5158 -61.5135 -50.6278 -50.6182 -18.7922 -18.7781 -18.4119 -18.3958 -16.7563 -16.6986 -16.5332 -16.5213 -16.3293 -16.2805 -10.1775 -9.8895 -8.2418 -7.8163 0.4382 0.5163 3.9172 3.9705 6.3184 6.4220 8.1100 8.6840 9.5006 10.0707 12.6674 12.6835 14.0692 14.1331 k = 0.6357-0.0962-0.3614 ( 2994 PWs) bands (ev): ************************************-176.0372-176.0191-138.2704-138.2645 -92.7491 -92.7491 -64.3574 -64.3555 -63.4814 -63.4804 -61.5161 -61.5138 -50.6886 -50.6763 -18.7894 -18.7758 -18.4219 -18.4064 -16.7542 -16.6932 -16.5325 -16.5193 -16.3461 -16.2955 -10.2399 -9.9661 -8.2346 -7.8262 0.3961 0.4683 4.0505 4.0977 6.4791 6.5842 8.0856 8.6618 9.4639 10.0173 12.6991 12.7161 14.1762 14.2345 k = 0.6312-0.0885-0.3466 ( 2996 PWs) bands (ev): ************************************-176.0394-176.0204-138.2734-138.2652 -92.7498 -92.7498 -64.3562 -64.3543 -63.4800 -63.4790 -61.5163 -61.5141 -50.6987 -50.6852 -18.7879 -18.7748 -18.4328 -18.4181 -16.7498 -16.6850 -16.5327 -16.5174 -16.3618 -16.3092 -10.3015 -10.0405 -8.2275 -7.8340 0.3522 0.4187 4.1887 4.2306 6.6381 6.7445 8.0632 8.6398 9.4284 9.9648 12.7265 12.7429 14.2856 14.3466 k = 0.6266-0.0808-0.3318 ( 2996 PWs) bands (ev): ************************************-176.0389-176.0201-138.2726-138.2662 -92.7502 -92.7502 -64.3549 -64.3531 -63.4785 -63.4776 -61.5165 -61.5143 -50.6957 -50.6875 -18.7829 -18.7703 -18.4429 -18.4287 -16.7465 -16.6782 -16.5318 -16.5142 -16.3757 -16.3218 -10.3607 -10.1132 -8.2171 -7.8345 0.3065 0.3679 4.3314 4.3687 6.7948 6.9022 8.0433 8.6172 9.3939 9.9135 12.7493 12.7639 14.3827 14.4446 k = 0.6221-0.0731-0.3170 ( 2996 PWs) bands (ev): ************************************-176.0379-176.0229-138.2730-138.2671 -92.7505 -92.7505 -64.3536 -64.3518 -63.4771 -63.4762 -61.5167 -61.5145 -50.7139 -50.7044 -18.7775 -18.7653 -18.4538 -18.4401 -16.7441 -16.6719 -16.5305 -16.5095 -16.3896 -16.3349 -10.4188 -10.1834 -8.2065 -7.8387 0.2597 0.3168 4.4768 4.5097 6.9487 7.0568 8.0259 8.5954 9.3593 9.8616 12.7664 12.7782 14.4895 14.5639 k = 0.6176-0.0653-0.3022 ( 2996 PWs) bands (ev): ************************************-176.0378-176.0225-138.2728-138.2675 -92.7508 -92.7508 -64.3524 -64.3506 -63.4756 -63.4748 -61.5169 -61.5147 -50.7153 -50.7056 -18.7737 -18.7620 -18.4636 -18.4506 -16.7403 -16.6637 -16.5313 -16.5062 -16.4020 -16.3465 -10.4748 -10.2513 -8.1939 -7.8402 0.2120 0.2652 4.6248 4.6537 7.0989 7.2075 8.0123 8.5746 9.3258 9.8110 12.7772 12.7857 14.5704 14.6447 k = 0.6131-0.0576-0.2875 ( 2994 PWs) bands (ev): ************************************-176.0372-176.0218-138.2724-138.2698 -92.7508 -92.7508 -64.3511 -64.3494 -63.4742 -63.4735 -61.5169 -61.5148 -50.7097 -50.6996 -18.7646 -18.7530 -18.4783 -18.4655 -16.7364 -16.6553 -16.5293 -16.4981 -16.4122 -16.3577 -10.5297 -10.3179 -8.1845 -7.8442 0.1646 0.2142 4.7754 4.8004 7.2435 7.3524 8.0031 8.5546 9.2933 9.7613 12.7811 12.7871 14.6576 14.7400 k = 0.6085-0.0499-0.2727 ( 2994 PWs) bands (ev): ************************************-176.0343-176.0222-138.2716-138.2671 -92.7512 -92.7512 -64.3500 -64.3484 -63.4729 -63.4722 -61.5169 -61.5148 -50.6572 -50.6430 -18.7624 -18.7513 -18.4917 -18.4795 -16.7292 -16.6428 -16.5327 -16.4963 -16.4203 -16.3649 -10.5819 -10.3806 -8.1645 -7.8416 0.1182 0.1647 4.9269 4.9482 7.3837 7.4924 8.0004 8.5389 9.2624 9.7138 12.7760 12.7825 14.7289 14.8122 k = 0.6040-0.0422-0.2579 ( 2994 PWs) bands (ev): ************************************-176.0319-176.0225-138.2715-138.2677 -92.7515 -92.7515 -64.3488 -64.3472 -63.4715 -63.4709 -61.5171 -61.5151 -50.6471 -50.6341 -18.7561 -18.7455 -18.5019 -18.4901 -16.7289 -16.6394 -16.5353 -16.4932 -16.4280 -16.3749 -10.6330 -10.4420 -8.1517 -7.8414 0.0712 0.1148 5.0776 5.0948 7.5153 7.6241 8.0072 8.5256 9.2325 9.6671 12.7623 12.7722 14.7992 14.8814 k = 0.5995-0.0344-0.2431 ( 2998 PWs) bands (ev): ************************************-176.0329-176.0262-138.2746-138.2690 -92.7525 -92.7525 -64.3478 -64.3463 -63.4703 -63.4697 -61.5174 -61.5154 -50.6977 -50.6820 -18.7567 -18.7468 -18.5114 -18.5006 -16.7280 -16.6354 -16.5426 -16.4969 -16.4367 -16.3834 -10.6827 -10.5015 -8.1420 -7.8457 0.0235 0.0647 5.2263 5.2397 7.6349 7.7449 8.0273 8.5160 9.2026 9.6200 12.7401 12.7543 14.8605 14.9389 k = 0.5950-0.0267-0.2283 ( 2998 PWs) bands (ev): ************************************-176.0346-176.0270-138.2764-138.2691 -92.7529 -92.7529 -64.3467 -64.3452 -63.4689 -63.4684 -61.5175 -61.5156 -50.7164 -50.6968 -18.7529 -18.7436 -18.5190 -18.5089 -16.7277 -16.6337 -16.5454 -16.4960 -16.4422 -16.3906 -10.7299 -10.5586 -8.1284 -7.8491 -0.0228 0.0163 5.3753 5.3859 7.7355 7.8531 8.0704 8.5130 9.1746 9.5750 12.7107 12.7290 14.9113 14.9861 k = 0.5905-0.0190-0.2135 ( 3002 PWs) bands (ev): ************************************-176.0373-176.0292-138.2789-138.2743 -92.7538 -92.7538 -64.3457 -64.3443 -63.4678 -63.4674 -61.5177 -61.5159 -50.7600 -50.7447 -18.7507 -18.7418 -18.5324 -18.5227 -16.7302 -16.6364 -16.5477 -16.4940 -16.4475 -16.3998 -10.7762 -10.6144 -8.1278 -7.8563 -0.0684 -0.0313 5.5197 5.5299 7.8072 7.9493 8.1398 8.5175 9.1478 9.5313 12.6740 12.6961 14.9638 15.0352 k = 0.5859-0.0112-0.1988 ( 3002 PWs) bands (ev): ************************************-176.0374-176.0288-138.2787-138.2746 -92.7541 -92.7541 -64.3447 -64.3433 -63.4666 -63.4662 -61.5179 -61.5161 -50.7611 -50.7455 -18.7472 -18.7389 -18.5410 -18.5320 -16.7306 -16.6386 -16.5471 -16.4915 -16.4501 -16.4055 -10.8189 -10.6664 -8.1148 -7.8563 -0.1119 -0.0767 5.6603 5.6740 7.8571 8.0376 8.2277 8.5369 9.1234 9.4911 12.6306 12.6560 15.0192 15.0870 k = 0.5814-0.0035-0.1840 ( 3000 PWs) bands (ev): ************************************-176.0344-176.0276-138.2774-138.2722 -92.7541 -92.7541 -64.3436 -64.3423 -63.4654 -63.4650 -61.5179 -61.5161 -50.7198 -50.7017 -18.7438 -18.7361 -18.5486 -18.5402 -16.7295 -16.6413 -16.5428 -16.4888 -16.4502 -16.4074 -10.8587 -10.7152 -8.0953 -7.8525 -0.1529 -0.1195 5.7963 5.8164 7.8962 8.1146 8.3228 8.5721 9.1017 9.4544 12.5807 12.6088 15.0764 15.1424 k = 0.5769 0.0042-0.1692 ( 3002 PWs) bands (ev): ************************************-176.0354-176.0284-138.2781-138.2743 -92.7547 -92.7547 -64.3428 -64.3415 -63.4644 -63.4641 -61.5180 -61.5163 -50.7460 -50.7318 -18.7442 -18.7372 -18.5569 -18.5493 -16.7313 -16.6482 -16.5394 -16.4876 -16.4513 -16.4110 -10.8976 -10.7631 -8.0865 -7.8563 -0.1937 -0.1620 5.9241 5.9521 7.9315 8.1760 8.4182 8.6209 9.0806 9.4184 12.5242 12.5547 15.1334 15.1987 k = 0.5724 0.0119-0.1544 ( 2998 PWs) bands (ev): ************************************-176.0336-176.0251-138.2740-138.2709 -92.7542 -92.7542 -64.3417 -64.3405 -63.4631 -63.4628 -61.5180 -61.5164 -50.6930 -50.6818 -18.7395 -18.7331 -18.5600 -18.5532 -16.7316 -16.6547 -16.5325 -16.4853 -16.4493 -16.4106 -10.9324 -10.8072 -8.0647 -7.8442 -0.2316 -0.2014 6.0481 6.0850 7.9714 8.2261 8.5124 8.6834 9.0640 9.3877 12.4621 12.4946 15.1947 15.2586 k = 0.5678 0.0197-0.1396 ( 2996 PWs) bands (ev): ************************************-176.0312-176.0235-138.2729-138.2684 -92.7542 -92.7542 -64.3407 -64.3396 -63.4620 -63.4618 -61.5180 -61.5165 -50.6591 -50.6502 -18.7364 -18.7306 -18.5663 -18.5601 -16.7336 -16.6636 -16.5248 -16.4823 -16.4461 -16.4097 -10.9655 -10.8491 -8.0465 -7.8390 -0.2673 -0.2388 6.1628 6.2095 8.0166 8.2681 8.6026 8.7513 9.0492 9.3599 12.3941 12.4283 15.2610 15.3249 k = 0.5633 0.0274-0.1249 ( 2998 PWs) bands (ev): ************************************-176.0324-176.0243-138.2742-138.2687 -92.7547 -92.7547 -64.3400 -64.3389 -63.4611 -63.4609 -61.5181 -61.5167 -50.6805 -50.6692 -18.7347 -18.7294 -18.5755 -18.5698 -16.7374 -16.6732 -16.5208 -16.4816 -16.4456 -16.4117 -10.9973 -10.8893 -8.0362 -7.8409 -0.3022 -0.2753 6.2671 6.3240 8.0677 8.3065 8.6876 8.8179 9.0381 9.3346 12.3206 12.3564 15.3313 15.3948 k = 0.5588 0.0351-0.1101 ( 3002 PWs) bands (ev): ************************************-176.0345-176.0256-138.2787-138.2703 -92.7557 -92.7557 -64.3394 -64.3384 -63.4604 -63.4602 -61.5182 -61.5169 -50.7244 -50.7130 -18.7377 -18.7331 -18.5843 -18.5794 -16.7423 -16.6844 -16.5161 -16.4807 -16.4441 -16.4129 -11.0278 -10.9277 -8.0321 -7.8497 -0.3360 -0.3108 6.3611 6.4281 8.1256 8.3456 8.7656 8.8784 9.0325 9.3140 12.2425 12.2798 15.4045 15.4706 k = 0.5543 0.0428-0.0953 ( 3004 PWs) bands (ev): ************************************-176.0358-176.0259-138.2818-138.2709 -92.7562 -92.7561 -64.3386 -64.3377 -63.4595 -63.4594 -61.5185 -61.5172 -50.7439 -50.7309 -18.7333 -18.7291 -18.5919 -18.5874 -16.7497 -16.6979 -16.5123 -16.4804 -16.4431 -16.4153 -11.0549 -10.9634 -8.0263 -7.8516 -0.3670 -0.3434 6.4465 6.5224 8.1918 8.3892 8.8345 8.9237 9.0420 9.3012 12.1605 12.1993 15.4805 15.5468 k = 0.5497 0.0506-0.0805 ( 3010 PWs) bands (ev): ************************************-176.0397-176.0292-138.2884-138.2746 -92.7574 -92.7574 -64.3381 -64.3373 -63.4590 -63.4589 -61.5186 -61.5174 -50.8184 -50.8022 -18.7373 -18.7337 -18.6012 -18.5974 -16.7554 -16.7087 -16.5101 -16.4800 -16.4434 -16.4191 -11.0818 -10.9981 -8.0290 -7.8668 -0.3964 -0.3744 6.5186 6.6020 8.2638 8.4366 8.8900 8.9492 9.0700 9.2956 12.0750 12.1150 15.5613 15.6370 k = 0.5452 0.0583-0.0657 ( 3012 PWs) bands (ev): ************************************-176.0422-176.0296-138.2922-138.2744 -92.7579 -92.7579 -64.3376 -64.3368 -63.4584 -63.4583 -61.5187 -61.5176 -50.8424 -50.8263 -18.7401 -18.7372 -18.6057 -18.6027 -16.7594 -16.7179 -16.5059 -16.4793 -16.4411 -16.4193 -11.1044 -11.0293 -8.0248 -7.8732 -0.4230 -0.4025 6.5838 6.6721 8.3420 8.4901 8.9233 8.9706 9.1118 9.3016 11.9873 12.0285 15.6418 15.7534 k = 0.5407 0.0660-0.0509 ( 3010 PWs) bands (ev): ************************************-176.0403-176.0285-138.2905-138.2735 -92.7578 -92.7578 -64.3370 -64.3362 -63.4577 -63.4576 -61.5186 -61.5176 -50.8394 -50.8230 -18.7388 -18.7364 -18.6097 -18.6072 -16.7604 -16.7238 -16.5002 -16.4769 -16.4367 -16.4166 -11.1240 -11.0566 -8.0110 -7.8715 -0.4460 -0.4274 6.6407 6.7314 8.4241 8.5488 8.9347 8.9974 9.1581 9.3191 11.8986 11.9406 15.7212 15.8809 k = 0.5362 0.0738-0.0362 ( 3008 PWs) bands (ev): ************************************-176.0381-176.0265-138.2871-138.2725 -92.7576 -92.7576 -64.3364 -64.3357 -63.4570 -63.4569 -61.5185 -61.5176 -50.7982 -50.7845 -18.7365 -18.7345 -18.6127 -18.6106 -16.7626 -16.7309 -16.4950 -16.4754 -16.4320 -16.4139 -11.1408 -11.0813 -7.9931 -7.8698 -0.4657 -0.4491 6.6909 6.7807 8.5062 8.6092 8.9403 9.0204 9.2054 9.3448 11.8101 11.8526 15.7942 15.9692 k = 0.5317 0.0815-0.0214 ( 3006 PWs) bands (ev): ************************************-176.0337-176.0230-138.2838-138.2721 -92.7574 -92.7574 -64.3359 -64.3353 -63.4565 -63.4564 -61.5184 -61.5176 -50.7699 -50.7549 -18.7353 -18.7338 -18.6175 -18.6159 -16.7635 -16.7366 -16.4889 -16.4730 -16.4254 -16.4092 -11.1555 -11.1034 -7.9765 -7.8667 -0.4836 -0.4691 6.7338 6.8192 8.5838 8.6675 8.9475 9.0392 9.2514 9.3744 11.7234 11.7656 15.8692 16.0599 k = 0.5271 0.0892-0.0066 ( 3006 PWs) bands (ev): ************************************-176.0339-176.0226-138.2857-138.2703 -92.7576 -92.7576 -64.3355 -64.3350 -63.4560 -63.4560 -61.5184 -61.5177 -50.7676 -50.7552 -18.7352 -18.7341 -18.6200 -18.6187 -16.7654 -16.7426 -16.4863 -16.4730 -16.4225 -16.4086 -11.1674 -11.1227 -7.9666 -7.8733 -0.4994 -0.4871 6.7694 6.8482 8.6519 8.7211 8.9588 9.0564 9.2962 9.4044 11.6405 11.6814 15.9331 16.1873 k = 0.5226 0.0969 0.0082 ( 3006 PWs) bands (ev): ************************************-176.0345-176.0219-138.2882-138.2677 -92.7577 -92.7577 -64.3351 -64.3347 -63.4556 -63.4556 -61.5183 -61.5178 -50.7668 -50.7569 -18.7353 -18.7344 -18.6220 -18.6211 -16.7668 -16.7481 -16.4839 -16.4733 -16.4198 -16.4081 -11.1766 -11.1393 -7.9563 -7.8813 -0.5127 -0.5027 6.7998 6.8694 8.7067 8.7652 8.9786 9.0747 9.3388 9.4327 11.5637 11.6020 15.9881 16.0932 k = 0.5181 0.1047 0.0230 ( 3010 PWs) bands (ev): ************************************-176.0367-176.0268-138.2907-138.2749 -92.7584 -92.7584 -64.3348 -64.3345 -63.4553 -63.4552 -61.5187 -61.5183 -50.8321 -50.8247 -18.7353 -18.7347 -18.6223 -18.6216 -16.7765 -16.7620 -16.4847 -16.4767 -16.4192 -16.4098 -11.1858 -11.1554 -7.9568 -7.8976 -0.5251 -0.5170 6.8217 6.8793 8.7453 8.7940 9.0082 9.0936 9.3787 9.4577 11.4956 11.5297 16.0312 16.1030 k = 0.5136 0.1124 0.0378 ( 3010 PWs) bands (ev): ************************************-176.0366-176.0267-138.2910-138.2745 -92.7584 -92.7584 -64.3345 -64.3343 -63.4550 -63.4550 -61.5187 -61.5184 -50.8328 -50.8253 -18.7354 -18.7349 -18.6235 -18.6230 -16.7767 -16.7660 -16.4831 -16.4772 -16.4171 -16.4100 -11.1908 -11.1679 -7.9487 -7.9026 -0.5331 -0.5271 6.8424 6.8870 8.7730 8.8104 9.0442 9.1114 9.4151 9.4773 11.4398 11.4677 16.0694 16.1179 k = 0.5090 0.1201 0.0525 ( 3018 PWs) bands (ev): ************************************-176.0431-176.0324-138.2974-138.2815 -92.7598 -92.7598 -64.3346 -64.3344 -63.4551 -63.4551 -61.5190 -61.5188 -50.8975 -50.8908 -18.7402 -18.7399 -18.6279 -18.6276 -16.7859 -16.7789 -16.4846 -16.4809 -16.4174 -16.4128 -11.1952 -11.1797 -7.9615 -7.9235 -0.5414 -0.5374 6.8566 6.8866 8.7890 8.8145 9.0780 9.1234 9.4459 9.4892 11.3983 11.4184 16.0846 16.1164 k = 0.5045 0.1278 0.0673 ( 3018 PWs) bands (ev): ************************************-176.0392-176.0356-138.2925-138.2878 -92.7599 -92.7599 -64.3344 -64.3343 -63.4550 -63.4550 -61.5190 -61.5189 -50.8913 -50.8871 -18.7404 -18.7403 -18.6285 -18.6284 -16.7840 -16.7805 -16.4841 -16.4822 -16.4157 -16.4134 -11.1948 -11.1873 -7.9527 -7.9353 -0.5438 -0.5417 6.8694 6.8847 8.8025 8.8156 9.1050 9.1277 9.4705 9.4927 11.3749 11.3853 16.0950 16.1180 k = 0.5000 0.1356 0.0821 ( 3022 PWs) bands (ev): ************************************-176.0419-176.0419-138.2953-138.2953 -92.7605 -92.7605 -64.3344 -64.3344 -63.4549 -63.4549 -61.5193 -61.5193 -50.9498 -50.9498 -18.7405 -18.7405 -18.6287 -18.6287 -16.7916 -16.7916 -16.4838 -16.4838 -16.4169 -16.4169 -11.1936 -11.1936 -7.9561 -7.9561 -0.5460 -0.5460 6.8761 6.8761 8.8090 8.8090 9.1217 9.1217 9.4864 9.4864 11.3700 11.3700 16.1024 16.1224 k = 0.5000 0.1356 0.0821 ( 3022 PWs) bands (ev): ************************************-176.0419-176.0419-138.2953-138.2953 -92.7605 -92.7605 -64.3344 -64.3344 -63.4549 -63.4549 -61.5193 -61.5193 -50.9498 -50.9498 -18.7405 -18.7405 -18.6287 -18.6287 -16.7916 -16.7916 -16.4838 -16.4838 -16.4169 -16.4169 -11.1936 -11.1936 -7.9561 -7.9561 -0.5460 -0.5460 6.8761 6.8761 8.8090 8.8090 9.1217 9.1217 9.4864 9.4864 11.3700 11.3700 16.1055 16.1168 k = 0.4839 0.1312 0.0795 ( 3010 PWs) bands (ev): ************************************-176.0379-176.0229-138.2962-138.2659 -92.7587 -92.7587 -64.3343 -64.3343 -63.4549 -63.4549 -61.5182 -61.5182 -50.8302 -50.8172 -18.7401 -18.7401 -18.6284 -18.6284 -16.7669 -16.7668 -16.4787 -16.4787 -16.4124 -16.4123 -11.1901 -11.1890 -7.9323 -7.9148 -0.5464 -0.5338 6.8409 6.8990 8.8041 8.8432 9.1215 9.1229 9.4867 9.4879 11.3656 11.3843 16.1020 16.1161 k = 0.4677 0.1268 0.0768 ( 3010 PWs) bands (ev): ************************************-176.0371-176.0226-138.2957-138.2661 -92.7588 -92.7588 -64.3343 -64.3343 -63.4549 -63.4549 -61.5183 -61.5182 -50.8306 -50.8184 -18.7401 -18.7401 -18.6284 -18.6283 -16.7677 -16.7676 -16.4789 -16.4789 -16.4126 -16.4125 -11.1903 -11.1875 -7.9358 -7.9148 -0.5468 -0.5221 6.7747 6.8882 8.8170 8.8926 9.1213 9.1241 9.4872 9.4895 11.3682 11.4051 16.1039 16.1306 k = 0.4516 0.1224 0.0742 ( 3010 PWs) bands (ev): ************************************-176.0364-176.0224-138.2952-138.2664 -92.7588 -92.7588 -64.3343 -64.3343 -63.4549 -63.4549 -61.5183 -61.5182 -50.8310 -50.8195 -18.7400 -18.7400 -18.6283 -18.6283 -16.7683 -16.7683 -16.4791 -16.4790 -16.4128 -16.4126 -11.1902 -11.1856 -7.9405 -7.9157 -0.5434 -0.5068 6.6896 6.8512 8.8512 8.9550 9.1214 9.1264 9.4885 9.4919 11.3785 11.4341 16.0954 16.1243 k = 0.4355 0.1181 0.0715 ( 3010 PWs) bands (ev): ************************************-176.0358-176.0222-138.2948-138.2667 -92.7589 -92.7589 -64.3343 -64.3343 -63.4549 -63.4549 -61.5183 -61.5182 -50.8312 -50.8205 -18.7400 -18.7400 -18.6283 -18.6282 -16.7690 -16.7689 -16.4792 -16.4792 -16.4129 -16.4127 -11.1897 -11.1832 -7.9461 -7.9176 -0.5363 -0.4879 6.5896 6.7910 8.9031 9.0237 9.1220 9.1316 9.4908 9.4955 11.3970 11.4717 16.0872 16.1160 k = 0.4194 0.1137 0.0689 ( 3013 PWs) bands (ev): ************************************-176.0398-176.0244-138.2993-138.2702 -92.7593 -92.7593 -64.3343 -64.3343 -63.4549 -63.4549 -61.5186 -61.5185 -50.8476 -50.8367 -18.7395 -18.7394 -18.6277 -18.6277 -16.7749 -16.7748 -16.4819 -16.4818 -16.4155 -16.4153 -11.1891 -11.1814 -7.9625 -7.9315 -0.5261 -0.4663 6.4770 6.7105 8.9670 9.0825 9.1232 9.1503 9.4939 9.5005 11.4238 11.5178 16.0966 16.1312 k = 0.4032 0.1093 0.0662 ( 3013 PWs) bands (ev): ************************************-176.0391-176.0243-138.2989-138.2704 -92.7594 -92.7594 -64.3343 -64.3343 -63.4549 -63.4549 -61.5186 -61.5185 -50.8478 -50.8377 -18.7394 -18.7393 -18.6276 -18.6276 -16.7756 -16.7755 -16.4820 -16.4819 -16.4156 -16.4155 -11.1877 -11.1783 -7.9699 -7.9354 -0.5115 -0.4407 6.3576 6.6156 9.0365 9.1070 9.1285 9.2042 9.4997 9.5087 11.4595 11.5736 16.0757 16.0958 k = 0.3871 0.1050 0.0636 ( 3013 PWs) bands (ev): ************************************-176.0385-176.0243-138.2985-138.2707 -92.7594 -92.7594 -64.3343 -64.3343 -63.4549 -63.4549 -61.5186 -61.5185 -50.8480 -50.8386 -18.7393 -18.7392 -18.6275 -18.6275 -16.7761 -16.7760 -16.4821 -16.4820 -16.4157 -16.4155 -11.1859 -11.1748 -7.9780 -7.9402 -0.4934 -0.4119 6.2325 6.5091 9.0908 9.1131 9.1525 9.2712 9.5088 9.5219 11.5047 11.6392 16.0851 16.1288 k = 0.3710 0.1006 0.0609 ( 3013 PWs) bands (ev): ************************************-176.0379-176.0243-138.2981-138.2710 -92.7594 -92.7594 -64.3343 -64.3343 -63.4549 -63.4549 -61.5186 -61.5186 -50.8480 -50.8393 -18.7391 -18.7391 -18.6274 -18.6274 -16.7766 -16.7765 -16.4821 -16.4820 -16.4157 -16.4156 -11.1837 -11.1711 -7.9867 -7.9459 -0.4717 -0.3801 6.1036 6.3941 9.1076 9.1154 9.2120 9.3309 9.5229 9.5437 11.5599 11.7147 16.0812 16.1374 k = 0.3548 0.0962 0.0583 ( 3013 PWs) bands (ev): ************************************-176.0374-176.0245-138.2977-138.2713 -92.7594 -92.7594 -64.3343 -64.3343 -63.4549 -63.4549 -61.5186 -61.5186 -50.8478 -50.8399 -18.7390 -18.7389 -18.6273 -18.6272 -16.7770 -16.7769 -16.4821 -16.4820 -16.4157 -16.4155 -11.1811 -11.1672 -7.9959 -7.9525 -0.4466 -0.3455 5.9724 6.2728 9.1119 9.1165 9.2759 9.3754 9.5447 9.5781 11.6255 11.8005 16.0860 16.1317 k = 0.3387 0.0918 0.0556 ( 3013 PWs) bands (ev): ************************************-176.0370-176.0247-138.2974-138.2717 -92.7593 -92.7593 -64.3343 -64.3343 -63.4549 -63.4549 -61.5186 -61.5186 -50.8476 -50.8404 -18.7388 -18.7388 -18.6271 -18.6270 -16.7774 -16.7773 -16.4820 -16.4819 -16.4155 -16.4154 -11.1781 -11.1630 -8.0056 -7.9599 -0.4183 -0.3083 5.8403 6.1474 9.1137 9.1174 9.3289 9.4036 9.5774 9.6244 11.7020 11.8963 16.0796 16.1193 k = 0.3226 0.0875 0.0530 ( 3025 PWs) bands (ev): ************************************-176.0437-176.0368-138.3019-138.2866 -92.7614 -92.7614 -64.3347 -64.3347 -63.4553 -63.4553 -61.5189 -61.5188 -50.9880 -50.9838 -18.7464 -18.7463 -18.6346 -18.6346 -16.7789 -16.7788 -16.4912 -16.4911 -16.4248 -16.4247 -11.1766 -11.1610 -8.0380 -7.9981 -0.3912 -0.2730 5.7007 6.0130 9.1137 9.1172 9.3649 9.4190 9.6188 9.6750 11.7878 12.0007 16.0569 16.0798 k = 0.3065 0.0831 0.0503 ( 3022 PWs) bands (ev): ************************************-176.0418-176.0333-138.3005-138.2812 -92.7609 -92.7609 -64.3347 -64.3347 -63.4553 -63.4553 -61.5186 -61.5186 -50.9504 -50.9452 -18.7462 -18.7462 -18.6345 -18.6344 -16.7730 -16.7729 -16.4897 -16.4896 -16.4234 -16.4234 -11.1723 -11.1550 -8.0422 -7.9976 -0.3562 -0.2306 5.5719 5.8852 9.1143 9.1178 9.3900 9.4289 9.6711 9.7293 11.8869 12.1165 16.0742 16.1146 k = 0.2903 0.0787 0.0477 ( 3016 PWs) bands (ev): ************************************-176.0384-176.0286-138.2937-138.2789 -92.7598 -92.7598 -64.3344 -64.3344 -63.4550 -63.4550 -61.5186 -61.5186 -50.9089 -50.9053 -18.7400 -18.7399 -18.6282 -18.6282 -16.7706 -16.7705 -16.4887 -16.4886 -16.4225 -16.4224 -11.1671 -11.1494 -8.0378 -7.9963 -0.3174 -0.1854 5.4444 5.7570 9.1154 9.1191 9.4066 9.4358 9.7269 9.7814 11.9966 12.2407 16.0826 16.1024 k = 0.2742 0.0743 0.0450 ( 3016 PWs) bands (ev): ************************************-176.0384-176.0286-138.2934-138.2794 -92.7598 -92.7598 -64.3344 -64.3344 -63.4550 -63.4550 -61.5186 -61.5186 -50.9084 -50.9052 -18.7399 -18.7398 -18.6281 -18.6280 -16.7708 -16.7707 -16.4885 -16.4884 -16.4223 -16.4222 -11.1630 -11.1448 -8.0482 -8.0061 -0.2780 -0.1406 5.3175 5.6277 9.1157 9.1195 9.4170 9.4399 9.7802 9.8288 12.1159 12.3722 16.0686 16.0992 k = 0.2581 0.0700 0.0424 ( 3010 PWs) bands (ev): ************************************-176.0336-176.0240-138.2861-138.2757 -92.7587 -92.7587 -64.3343 -64.3343 -63.4548 -63.4548 -61.5184 -61.5183 -50.8309 -50.8278 -18.7372 -18.7371 -18.6254 -18.6254 -16.7705 -16.7704 -16.4818 -16.4817 -16.4154 -16.4153 -11.1578 -11.1397 -8.0453 -8.0017 -0.2347 -0.0934 5.1983 5.5039 9.1166 9.1204 9.4246 9.4432 9.8313 9.8729 12.2455 12.5112 16.0778 16.1070 k = 0.2419 0.0656 0.0397 ( 3010 PWs) bands (ev): ************************************-176.0337-176.0241-138.2858-138.2762 -92.7586 -92.7586 -64.3343 -64.3343 -63.4548 -63.4548 -61.5184 -61.5183 -50.8305 -50.8273 -18.7370 -18.7370 -18.6253 -18.6253 -16.7706 -16.7705 -16.4816 -16.4814 -16.4151 -16.4150 -11.1534 -11.1351 -8.0555 -8.0121 -0.1913 -0.0469 5.0783 5.3780 9.1169 9.1207 9.4297 9.4452 9.8766 9.9115 12.3825 12.6553 16.0687 16.0949 k = 0.2258 0.0612 0.0371 ( 3016 PWs) bands (ev): ************************************-176.0381-176.0281-138.2911-138.2827 -92.7596 -92.7596 -64.3344 -64.3344 -63.4550 -63.4549 -61.5187 -61.5187 -50.9257 -50.9246 -18.7381 -18.7381 -18.6264 -18.6263 -16.7733 -16.7732 -16.4880 -16.4879 -16.4217 -16.4216 -11.1495 -11.1317 -8.0787 -8.0356 -0.1481 -0.0015 4.9563 5.2501 9.1169 9.1207 9.4332 9.4464 9.9157 9.9452 12.5256 12.8028 16.0708 16.0972 k = 0.2097 0.0569 0.0344 ( 3016 PWs) bands (ev): ************************************-176.0382-176.0283-138.2908-138.2832 -92.7595 -92.7595 -64.3344 -64.3344 -63.4550 -63.4549 -61.5187 -61.5187 -50.9255 -50.9240 -18.7379 -18.7379 -18.6262 -18.6262 -16.7733 -16.7732 -16.4878 -16.4876 -16.4214 -16.4213 -11.1449 -11.1274 -8.0882 -8.0462 -0.1020 0.0450 4.8455 5.1301 9.1172 9.1209 9.4361 9.4475 9.9516 9.9756 12.6758 12.9550 16.0285 16.0540 k = 0.1935 0.0525 0.0318 ( 3016 PWs) bands (ev): ************************************-176.0385-176.0285-138.2906-138.2836 -92.7594 -92.7594 -64.3344 -64.3344 -63.4550 -63.4549 -61.5187 -61.5187 -50.9252 -50.9231 -18.7377 -18.7377 -18.6260 -18.6260 -16.7733 -16.7732 -16.4874 -16.4873 -16.4211 -16.4209 -11.1404 -11.1233 -8.0971 -8.0568 -0.0551 0.0908 4.7404 5.0139 9.1175 9.1211 9.4384 9.4483 9.9830 10.0023 12.8306 13.1093 16.0643 16.0768 k = 0.1774 0.0481 0.0291 ( 3010 PWs) bands (ev): ************************************-176.0350-176.0236-138.2843-138.2799 -92.7583 -92.7583 -64.3342 -64.3342 -63.4548 -63.4547 -61.5185 -61.5184 -50.8380 -50.8342 -18.7349 -18.7348 -18.6231 -18.6231 -16.7727 -16.7726 -16.4809 -16.4807 -16.4143 -16.4141 -11.1348 -11.1189 -8.0914 -8.0547 -0.0064 0.1367 4.6471 4.9076 9.1181 9.1215 9.4407 9.4493 10.0111 10.0267 12.9898 13.2649 16.0235 16.0468 k = 0.1613 0.0437 0.0265 ( 3007 PWs) bands (ev): ************************************-176.0364-176.0226-138.2891-138.2793 -92.7576 -92.7576 -64.3338 -64.3338 -63.4542 -63.4542 -61.5190 -61.5190 -50.8343 -50.8293 -18.7250 -18.7249 -18.6133 -18.6132 -16.7880 -16.7879 -16.4796 -16.4794 -16.4127 -16.4124 -11.1310 -11.1157 -8.1000 -8.0670 0.0409 0.1796 4.5573 4.8013 9.1197 9.1231 9.4433 9.4511 10.0348 10.0468 13.1480 13.4187 16.0498 16.0726 k = 0.1452 0.0394 0.0238 ( 3022 PWs) bands (ev): ************************************-176.0465-176.0371-138.3007-138.2962 -92.7600 -92.7600 -64.3341 -64.3341 -63.4546 -63.4546 -61.5197 -61.5197 -51.0064 -51.0052 -18.7300 -18.7300 -18.6183 -18.6182 -16.7902 -16.7901 -16.4955 -16.4953 -16.4290 -16.4289 -11.1282 -11.1144 -8.1442 -8.1127 0.0841 0.2173 4.4604 4.6906 9.1183 9.1216 9.4432 9.4497 10.0524 10.0632 13.3056 13.5684 16.0378 16.0485 k = 0.1290 0.0350 0.0212 ( 3022 PWs) bands (ev): ************************************-176.0464-176.0370-138.3005-138.2964 -92.7600 -92.7600 -64.3341 -64.3341 -63.4546 -63.4546 -61.5197 -61.5197 -51.0065 -51.0050 -18.7300 -18.7299 -18.6182 -18.6182 -16.7903 -16.7903 -16.4955 -16.4953 -16.4290 -16.4289 -11.1241 -11.1115 -8.1505 -8.1220 0.1291 0.2541 4.3843 4.5958 9.1186 9.1216 9.4443 9.4499 10.0698 10.0784 13.4641 13.7154 16.0289 16.0371 k = 0.1129 0.0306 0.0185 ( 3022 PWs) bands (ev): ************************************-176.0463-176.0370-138.3004-138.2966 -92.7600 -92.7600 -64.3341 -64.3341 -63.4546 -63.4546 -61.5197 -61.5197 -51.0067 -51.0045 -18.7299 -18.7299 -18.6182 -18.6181 -16.7904 -16.7903 -16.4954 -16.4952 -16.4289 -16.4288 -11.1203 -11.1090 -8.1558 -8.1308 0.1722 0.2872 4.3173 4.5080 9.1189 9.1216 9.4453 9.4500 10.0845 10.0913 13.6191 13.8555 16.0032 16.0142 k = 0.0968 0.0262 0.0159 ( 3019 PWs) bands (ev): ************************************-176.0428-176.0356-138.2970-138.2943 -92.7594 -92.7594 -64.3341 -64.3340 -63.4546 -63.4545 -61.5196 -61.5195 -50.9809 -50.9772 -18.7288 -18.7287 -18.6170 -18.6170 -16.7900 -16.7899 -16.4920 -16.4919 -16.4254 -16.4253 -11.1164 -11.1065 -8.1534 -8.1304 0.2135 0.3162 4.2620 4.4292 9.1198 9.1222 9.4465 9.4505 10.0973 10.1024 13.7685 13.9860 16.0050 16.0240 k = 0.0806 0.0219 0.0132 ( 3019 PWs) bands (ev): ************************************-176.0415-176.0348-138.2968-138.2943 -92.7594 -92.7594 -64.3340 -64.3340 -63.4545 -63.4545 -61.5196 -61.5196 -51.0105 -51.0079 -18.7280 -18.7280 -18.6163 -18.6163 -16.7931 -16.7931 -16.4912 -16.4911 -16.4244 -16.4243 -11.1131 -11.1056 -8.1560 -8.1340 0.2510 0.3401 4.2114 4.3562 9.1204 9.1223 9.4476 9.4510 10.1070 10.1116 13.9091 14.1025 16.0136 16.0215 k = 0.0645 0.0175 0.0106 ( 3019 PWs) bands (ev): ************************************-176.0412-176.0350-138.2965-138.2947 -92.7594 -92.7594 -64.3340 -64.3340 -63.4545 -63.4545 -61.5196 -61.5196 -51.0105 -51.0080 -18.7280 -18.7279 -18.6162 -18.6162 -16.7931 -16.7931 -16.4913 -16.4912 -16.4244 -16.4243 -11.1102 -11.1044 -8.1585 -8.1405 0.2847 0.3582 4.1749 4.2934 9.1206 9.1222 9.4482 9.4509 10.1151 10.1186 14.0373 14.2021 15.9837 15.9955 k = 0.0484 0.0131 0.0079 ( 3019 PWs) bands (ev): ************************************-176.0406-176.0351-138.2943-138.2929 -92.7595 -92.7595 -64.3342 -64.3342 -63.4547 -63.4547 -61.5193 -61.5193 -50.9813 -50.9781 -18.7315 -18.7315 -18.6198 -18.6198 -16.7874 -16.7873 -16.4895 -16.4894 -16.4228 -16.4228 -11.1080 -11.1034 -8.1575 -8.1437 0.3138 0.3708 4.1514 4.2425 9.1204 9.1216 9.4483 9.4504 10.1213 10.1239 14.1497 14.2804 15.9780 15.9865 k = 0.0323 0.0087 0.0053 ( 3025 PWs) bands (ev): ************************************-176.0418-176.0383-138.2975-138.2964 -92.7606 -92.7606 -64.3344 -64.3344 -63.4550 -63.4550 -61.5194 -61.5194 -51.0297 -51.0275 -18.7376 -18.7376 -18.6258 -18.6258 -16.7900 -16.7900 -16.4903 -16.4903 -16.4236 -16.4236 -11.1073 -11.1045 -8.1656 -8.1576 0.3372 0.3756 4.1339 4.1959 9.1198 9.1204 9.4477 9.4491 10.1253 10.1271 14.2412 14.3323 15.9721 15.9789 k = 0.0161 0.0044 0.0026 ( 3025 PWs) bands (ev): ************************************-176.0419-176.0384-138.2978-138.2964 -92.7605 -92.7605 -64.3344 -64.3344 -63.4550 -63.4550 -61.5194 -61.5194 -51.0296 -51.0275 -18.7375 -18.7375 -18.6257 -18.6257 -16.7899 -16.7899 -16.4903 -16.4903 -16.4236 -16.4236 -11.1056 -11.1047 -8.1649 -8.1614 0.3560 0.3752 4.1318 4.1638 9.1200 9.1202 9.4481 9.4489 10.1281 10.1290 14.3087 14.3552 15.9856 15.9904 k = 0.0000 0.0000 0.0000 ( 3027 PWs) bands (ev): ************************************-176.0418-176.0418-138.2990-138.2990 -92.7608 -92.7608 -64.3345 -64.3345 -63.4550 -63.4550 -61.5194 -61.5194 -51.0531 -51.0531 -18.7388 -18.7388 -18.6270 -18.6270 -16.7941 -16.7941 -16.4897 -16.4897 -16.4227 -16.4227 -11.1052 -11.1052 -8.1681 -8.1681 0.3680 0.3680 4.1391 4.1391 9.1204 9.1204 9.4487 9.4487 10.1292 10.1292 14.3473 14.3473 15.9871 15.9917 k = 0.0000 0.0000 0.0000 ( 3027 PWs) bands (ev): ************************************-176.0418-176.0418-138.2990-138.2990 -92.7608 -92.7608 -64.3345 -64.3345 -63.4550 -63.4550 -61.5194 -61.5194 -51.0531 -51.0531 -18.7388 -18.7388 -18.6270 -18.6270 -16.7941 -16.7941 -16.4897 -16.4897 -16.4227 -16.4227 -11.1052 -11.1052 -8.1681 -8.1681 0.3680 0.3680 4.1391 4.1391 9.1204 9.1204 9.4487 9.4487 10.1292 10.1292 14.3473 14.3473 15.9730 15.9775 k = 0.0045-0.0077-0.0147 ( 3021 PWs) bands (ev): ************************************-176.0409-176.0361-138.2979-138.2922 -92.7598 -92.7598 -64.3343 -64.3342 -63.4548 -63.4548 -61.5195 -61.5194 -50.9849 -50.9823 -18.7322 -18.7320 -18.6209 -18.6207 -16.7929 -16.7894 -16.4894 -16.4873 -16.4249 -16.4227 -11.1060 -11.0988 -8.1653 -8.1518 0.3686 0.3719 4.1387 4.1524 9.0944 9.1097 9.4161 9.4556 10.1339 10.1780 14.3429 14.3531 15.9770 15.9947 k = 0.0090-0.0154-0.0294 ( 3019 PWs) bands (ev): ************************************-176.0399-176.0357-138.2963-138.2904 -92.7594 -92.7594 -64.3343 -64.3342 -63.4548 -63.4547 -61.5195 -61.5193 -50.9527 -50.9512 -18.7299 -18.7297 -18.6196 -18.6193 -16.7932 -16.7862 -16.4920 -16.4881 -16.4235 -16.4189 -11.1052 -11.0905 -8.1677 -8.1400 0.3700 0.3768 4.1376 4.1651 9.0295 9.0593 9.3720 9.4352 10.1889 10.2648 14.3390 14.3595 15.9753 15.9938 k = 0.0135-0.0230-0.0441 ( 3017 PWs) bands (ev): ************************************-176.0385-176.0332-138.2941-138.2892 -92.7591 -92.7591 -64.3345 -64.3343 -63.4549 -63.4549 -61.5194 -61.5190 -50.9403 -50.9369 -18.7300 -18.7295 -18.6189 -18.6184 -16.7893 -16.7787 -16.4927 -16.4869 -16.4245 -16.4174 -11.1022 -11.0803 -8.1702 -8.1309 0.3734 0.3834 4.1392 4.1800 8.9294 8.9722 9.3309 9.4027 10.2771 10.3729 14.3357 14.3664 15.9418 15.9739 k = 0.0180-0.0307-0.0588 ( 3017 PWs) bands (ev): ************************************-176.0382-176.0348-138.2958-138.2894 -92.7591 -92.7590 -64.3347 -64.3344 -63.4552 -63.4552 -61.5194 -61.5190 -50.9603 -50.9589 -18.7305 -18.7299 -18.6171 -18.6165 -16.7890 -16.7747 -16.4942 -16.4862 -16.4271 -16.4178 -11.0977 -11.0680 -8.1795 -8.1307 0.3780 0.3910 4.1409 4.1948 8.8032 8.8559 9.2937 9.3677 10.3823 10.4913 14.3326 14.3733 15.9307 15.9785 k = 0.0225-0.0384-0.0735 ( 3023 PWs) bands (ev): ************************************-176.0419-176.0395-138.3032-138.2929 -92.7601 -92.7600 -64.3353 -64.3349 -63.4558 -63.4558 -61.5195 -61.5189 -51.0294 -51.0218 -18.7359 -18.7352 -18.6209 -18.6202 -16.7898 -16.7717 -16.4975 -16.4867 -16.4330 -16.4218 -11.0914 -11.0539 -8.2003 -8.1461 0.3836 0.3993 4.1412 4.2082 8.6592 8.7191 9.2551 9.3304 10.4950 10.6137 14.3289 14.3797 15.8914 15.9472 k = 0.0270-0.0461-0.0882 ( 3029 PWs) bands (ev): ************************************-176.0469-176.0459-138.3064-138.2988 -92.7610 -92.7610 -64.3358 -64.3353 -63.4564 -63.4564 -61.5197 -61.5190 -51.1024 -51.0975 -18.7411 -18.7400 -18.6212 -18.6200 -16.7915 -16.7694 -16.5030 -16.4888 -16.4403 -16.4274 -11.0828 -11.0372 -8.2232 -8.1537 0.3912 0.4094 4.1441 4.2235 8.5036 8.5685 9.2143 9.2916 10.6104 10.7373 14.3253 14.3858 15.8387 15.9111 k = 0.0315-0.0538-0.1029 ( 3031 PWs) bands (ev): ************************************-176.0511-176.0470-138.3077-138.3007 -92.7612 -92.7612 -64.3362 -64.3357 -63.4569 -63.4568 -61.5199 -61.5191 -51.1209 -51.1149 -18.7407 -18.7393 -18.6179 -18.6164 -16.7900 -16.7633 -16.5091 -16.4902 -16.4486 -16.4348 -11.0703 -11.0171 -8.2363 -8.1564 0.4011 0.4225 4.1548 4.2464 8.3412 8.4103 9.1692 9.2493 10.7252 10.8600 14.3217 14.3918 15.7711 15.8508 k = 0.0360-0.0615-0.1176 ( 3027 PWs) bands (ev): ************************************-176.0483-176.0436-138.3046-138.2960 -92.7604 -92.7604 -64.3366 -64.3359 -63.4572 -63.4572 -61.5198 -61.5189 -51.0834 -51.0716 -18.7379 -18.7361 -18.6127 -18.6108 -16.7865 -16.7557 -16.5107 -16.4896 -16.4484 -16.4319 -11.0546 -10.9938 -8.2322 -8.1440 0.4138 0.4383 4.1719 4.2757 8.1741 8.2468 9.1191 9.2029 10.8387 10.9812 14.3176 14.3972 15.7020 15.7891 k = 0.0405-0.0691-0.1323 ( 3027 PWs) bands (ev): ************************************-176.0491-176.0433-138.3045-138.2955 -92.7603 -92.7603 -64.3371 -64.3364 -63.4578 -63.4577 -61.5198 -61.5189 -51.1017 -51.0844 -18.7386 -18.7363 -18.6082 -18.6057 -16.7838 -16.7482 -16.5152 -16.4898 -16.4524 -16.4344 -11.0376 -10.9688 -8.2412 -8.1405 0.4272 0.4550 4.1880 4.3045 8.0029 8.0785 9.0632 9.1508 10.9486 11.0987 14.3116 14.4007 15.6263 15.7194 k = 0.0450-0.0768-0.1470 ( 3019 PWs) bands (ev): ************************************-176.0453-176.0345-138.2945-138.2901 -92.7588 -92.7588 -64.3375 -64.3367 -63.4583 -63.4581 -61.5195 -61.5184 -50.9552 -50.9448 -18.7367 -18.7340 -18.6006 -18.5978 -16.7759 -16.7367 -16.5134 -16.4885 -16.4470 -16.4250 -11.0168 -10.9403 -8.2326 -8.1129 0.4433 0.4748 4.2174 4.3460 7.8299 7.9081 9.0018 9.0936 11.0556 11.2136 14.3041 14.4028 15.5491 15.6455 k = 0.0495-0.0845-0.1617 ( 3019 PWs) bands (ev): ************************************-176.0465-176.0344-138.2966-138.2920 -92.7586 -92.7586 -64.3380 -64.3372 -63.4589 -63.4587 -61.5196 -61.5184 -50.9723 -50.9622 -18.7340 -18.7307 -18.5952 -18.5917 -16.7754 -16.7319 -16.5194 -16.4922 -16.4511 -16.4264 -10.9955 -10.9103 -8.2470 -8.1107 0.4599 0.4941 4.2389 4.3781 7.6548 7.7352 8.9334 9.0290 11.1575 11.3229 14.2929 14.4009 15.4699 15.5684 k = 0.0540-0.0922-0.1764 ( 3021 PWs) bands (ev): ************************************-176.0480-176.0348-138.2981-138.2924 -92.7588 -92.7588 -64.3388 -64.3378 -63.4597 -63.4595 -61.5197 -61.5184 -50.9742 -50.9639 -18.7363 -18.7325 -18.5905 -18.5864 -16.7728 -16.7241 -16.5261 -16.4959 -16.4560 -16.4290 -10.9715 -10.8781 -8.2588 -8.1110 0.4779 0.5152 4.2638 4.4134 7.4776 7.5604 8.8587 8.9581 11.2548 11.4275 14.2784 14.3958 15.3898 15.4890 k = 0.0584-0.0999-0.1910 ( 3015 PWs) bands (ev): ************************************-176.0464-176.0301-138.2929-138.2833 -92.7576 -92.7576 -64.3394 -64.3383 -63.4604 -63.4602 -61.5194 -61.5180 -50.8688 -50.8593 -18.7345 -18.7300 -18.5839 -18.5792 -16.7653 -16.7112 -16.5263 -16.4914 -16.4545 -16.4265 -10.9439 -10.8420 -8.2565 -8.0914 0.4980 0.5387 4.2982 4.4585 7.3008 7.3859 8.7782 8.8811 11.3481 11.5283 14.2603 14.3876 15.3109 15.4103 k = 0.0629-0.1075-0.2057 ( 3015 PWs) bands (ev): ************************************-176.0458-176.0315-138.2932-138.2837 -92.7574 -92.7574 -64.3401 -64.3390 -63.4613 -63.4611 -61.5193 -61.5179 -50.8665 -50.8619 -18.7371 -18.7320 -18.5768 -18.5714 -16.7615 -16.7020 -16.5321 -16.4945 -16.4575 -16.4262 -10.9148 -10.8048 -8.2698 -8.0853 0.5189 0.5632 4.3286 4.4987 7.1228 7.2100 8.6909 8.7970 11.4362 11.6238 14.2370 14.3744 15.2309 15.3315 k = 0.0674-0.1152-0.2204 ( 3019 PWs) bands (ev): ************************************-176.0489-176.0346-138.2981-138.2848 -92.7579 -92.7579 -64.3411 -64.3399 -63.4623 -63.4621 -61.5194 -61.5179 -50.9201 -50.9151 -18.7387 -18.7329 -18.5747 -18.5684 -16.7599 -16.6941 -16.5414 -16.5004 -16.4634 -16.4285 -10.8845 -10.7657 -8.2864 -8.0881 0.5405 0.5875 4.3577 4.5365 6.9450 7.0346 8.5965 8.7058 11.5196 11.7140 14.2094 14.3562 15.1483 15.2501 k = 0.0719-0.1229-0.2351 ( 3017 PWs) bands (ev): ************************************-176.0454-176.0330-138.2949-138.2829 -92.7574 -92.7574 -64.3419 -64.3407 -63.4633 -63.4630 -61.5193 -61.5177 -50.9139 -50.9070 -18.7389 -18.7324 -18.5672 -18.5602 -16.7562 -16.6846 -16.5459 -16.5008 -16.4643 -16.4270 -10.8505 -10.7232 -8.2908 -8.0785 0.5647 0.6145 4.3943 4.5808 6.7679 6.8605 8.4969 8.6089 11.5986 11.8000 14.1773 14.3340 15.0644 15.1679 k = 0.0764-0.1306-0.2498 ( 3013 PWs) bands (ev): ************************************-176.0425-176.0278-138.2929-138.2768 -92.7565 -92.7565 -64.3427 -64.3414 -63.4642 -63.4639 -61.5191 -61.5174 -50.8346 -50.8258 -18.7400 -18.7329 -18.5587 -18.5511 -16.7509 -16.6747 -16.5468 -16.5013 -16.4618 -16.4208 -10.8141 -10.6781 -8.2921 -8.0626 0.5898 0.6427 4.4375 4.6313 6.5919 6.6876 8.3912 8.5056 11.6734 11.8814 14.1408 14.3072 14.9775 15.0853 k = 0.0809-0.1383-0.2645 ( 3011 PWs) bands (ev): ************************************-176.0412-176.0277-138.2918-138.2766 -92.7559 -92.7559 -64.3435 -64.3422 -63.4652 -63.4648 -61.5190 -61.5173 -50.8313 -50.8240 -18.7418 -18.7342 -18.5461 -18.5380 -16.7476 -16.6662 -16.5528 -16.5069 -16.4630 -16.4167 -10.7749 -10.6299 -8.2999 -8.0572 0.6155 0.6716 4.4777 4.6770 6.4168 6.5168 8.2799 8.3961 11.7432 11.9574 14.0998 14.2752 14.8870 14.9982 k = 0.0854-0.1460-0.2792 ( 3013 PWs) bands (ev): ************************************-176.0421-176.0300-138.2927-138.2793 -92.7561 -92.7561 -64.3446 -64.3432 -63.4665 -63.4661 -61.5189 -61.5171 -50.8540 -50.8487 -18.7470 -18.7389 -18.5397 -18.5309 -16.7462 -16.6599 -16.5574 -16.5096 -16.4634 -16.4145 -10.7356 -10.5807 -8.3149 -8.0622 0.6412 0.7000 4.5191 4.7219 6.2428 6.3479 8.1624 8.2800 11.8083 12.0281 14.0548 14.2382 14.7925 14.9068 k = 0.0899-0.1536-0.2939 ( 3015 PWs) bands (ev): ************************************-176.0431-176.0316-138.2939-138.2820 -92.7562 -92.7562 -64.3457 -64.3443 -63.4678 -63.4673 -61.5189 -61.5170 -50.8849 -50.8783 -18.7509 -18.7422 -18.5337 -18.5242 -16.7458 -16.6555 -16.5617 -16.5124 -16.4632 -16.4122 -10.6944 -10.5291 -8.3308 -8.0665 0.6677 0.7291 4.5630 4.7670 6.0709 6.1827 8.0396 8.1582 11.8690 12.0939 14.0066 14.1962 14.6951 14.8110 k = 0.0944-0.1613-0.3086 ( 3011 PWs) bands (ev): ************************************-176.0400-176.0278-138.2918-138.2780 -92.7552 -92.7552 -64.3467 -64.3452 -63.4689 -63.4684 -61.5186 -61.5167 -50.8417 -50.8331 -18.7519 -18.7425 -18.5227 -18.5125 -16.7440 -16.6517 -16.5598 -16.5101 -16.4584 -16.4064 -10.6491 -10.4744 -8.3369 -8.0566 0.6951 0.7599 4.6134 4.8155 5.9020 6.0234 7.9124 8.0316 11.9254 12.1548 13.9564 14.1497 14.5983 14.7133 k = 0.0989-0.1690-0.3233 ( 3011 PWs) bands (ev): ************************************-176.0399-176.0282-138.2913-138.2784 -92.7550 -92.7550 -64.3478 -64.3462 -63.4702 -63.4696 -61.5185 -61.5165 -50.8412 -50.8324 -18.7556 -18.7457 -18.5136 -18.5028 -16.7436 -16.6509 -16.5600 -16.5132 -16.4549 -16.4002 -10.6029 -10.4176 -8.3479 -8.0543 0.7223 0.7900 4.6633 4.8588 5.7352 5.8704 7.7801 7.8997 11.9771 12.2099 13.9034 14.0973 14.5027 14.6135 k = 0.1034-0.1767-0.3380 ( 3013 PWs) bands (ev): ************************************-176.0419-176.0304-138.2927-138.2807 -92.7550 -92.7550 -64.3490 -64.3474 -63.4716 -63.4710 -61.5184 -61.5164 -50.8562 -50.8480 -18.7626 -18.7522 -18.5045 -18.4932 -16.7446 -16.6533 -16.5595 -16.5168 -16.4507 -16.3939 -10.5555 -10.3587 -8.3639 -8.0586 0.7492 0.8194 4.7137 4.8950 5.5707 5.7274 7.6432 7.7631 12.0235 12.2586 13.8482 14.0377 14.4080 14.5105 k = 0.1079-0.1844-0.3527 ( 3011 PWs) bands (ev): ************************************-176.0398-176.0277-138.2920-138.2778 -92.7544 -92.7544 -64.3501 -64.3485 -63.4729 -63.4723 -61.5181 -61.5160 -50.8307 -50.8236 -18.7663 -18.7555 -18.4947 -18.4828 -16.7429 -16.6540 -16.5569 -16.5199 -16.4419 -16.3826 -10.5045 -10.2970 -8.3697 -8.0512 0.7762 0.8491 4.7678 4.9230 5.4108 5.6021 7.5027 7.6225 12.0651 12.3012 13.7918 13.9711 14.3192 14.4089 k = 0.1124-0.1920-0.3674 ( 3005 PWs) bands (ev): ************************************-176.0354-176.0244-138.2858-138.2747 -92.7530 -92.7530 -64.3511 -64.3494 -63.4740 -63.4733 -61.5179 -61.5157 -50.7682 -50.7622 -18.7633 -18.7517 -18.4818 -18.4689 -16.7420 -16.6565 -16.5536 -16.5217 -16.4316 -16.3711 -10.4505 -10.2317 -8.3666 -8.0373 0.8029 0.8786 4.8221 4.9329 5.2560 5.5070 7.3592 7.4790 12.1014 12.3371 13.7350 13.8977 14.2367 14.3101 k = 0.1169-0.1997-0.3821 ( 3005 PWs) bands (ev): ************************************-176.0353-176.0249-138.2854-138.2752 -92.7527 -92.7527 -64.3523 -64.3505 -63.4754 -63.4747 -61.5177 -61.5156 -50.7671 -50.7611 -18.7671 -18.7550 -18.4720 -18.4585 -16.7441 -16.6628 -16.5523 -16.5251 -16.4218 -16.3611 -10.3970 -10.1654 -8.3778 -8.0338 0.8277 0.9061 4.8511 4.9272 5.1054 5.4501 7.2120 7.3314 12.1311 12.3638 13.6769 13.8159 14.1591 14.2152 k = 0.1214-0.2074-0.3968 ( 3007 PWs) bands (ev): ************************************-176.0387-176.0252-138.2900-138.2719 -92.7527 -92.7527 -64.3536 -64.3518 -63.4769 -63.4761 -61.5176 -61.5154 -50.7576 -50.7486 -18.7720 -18.7594 -18.4630 -18.4489 -16.7469 -16.6697 -16.5548 -16.5322 -16.4111 -16.3504 -10.3418 -10.0971 -8.3936 -8.0289 0.8508 0.9317 4.8029 4.9355 4.9866 5.4368 7.0620 7.1814 12.1536 12.3807 13.6191 13.7292 14.0825 14.1275 k = 0.1259-0.2151-0.4115 ( 3007 PWs) bands (ev): ************************************-176.0387-176.0258-138.2896-138.2724 -92.7523 -92.7523 -64.3548 -64.3530 -63.4784 -63.4775 -61.5174 -61.5152 -50.7564 -50.7472 -18.7756 -18.7625 -18.4531 -18.4383 -16.7500 -16.6772 -16.5548 -16.5356 -16.3984 -16.3389 -10.2851 -10.0262 -8.4046 -8.0242 0.8720 0.9553 4.7099 4.8093 5.0282 5.4557 6.9100 7.0289 12.1684 12.3869 13.5618 13.6407 14.0020 14.0533 k = 0.1304-0.2228-0.4262 ( 3013 PWs) bands (ev): ************************************-176.0433-176.0286-138.2954-138.2749 -92.7530 -92.7529 -64.3563 -64.3544 -63.4801 -63.4791 -61.5174 -61.5152 -50.8175 -50.8070 -18.7808 -18.7670 -18.4487 -18.4332 -16.7568 -16.6884 -16.5610 -16.5450 -16.3864 -16.3284 -10.2286 -9.9542 -8.4255 -8.0253 0.8901 0.9756 4.5989 4.6740 5.0856 5.4913 6.7556 6.8746 12.1739 12.3801 13.5033 13.5549 13.9185 13.9889 k = 0.1349-0.2305-0.4409 ( 3015 PWs) bands (ev): ************************************-176.0445-176.0309-138.2967-138.2780 -92.7529 -92.7529 -64.3576 -64.3557 -63.4816 -63.4805 -61.5173 -61.5151 -50.8414 -50.8321 -18.7842 -18.7699 -18.4413 -18.4251 -16.7632 -16.6993 -16.5623 -16.5486 -16.3721 -16.3164 -10.1703 -9.8789 -8.4408 -8.0250 0.9053 0.9928 4.4839 4.5447 5.1483 5.5383 6.6006 6.7199 12.1694 12.3602 13.4373 13.4833 13.8370 13.9305 k = 0.1394-0.2381-0.4556 ( 3021 PWs) bands (ev): ************************************-176.0493-176.0351-138.3024-138.2843 -92.7535 -92.7535 -64.3591 -64.3571 -63.4833 -63.4822 -61.5173 -61.5150 -50.9415 -50.9328 -18.7896 -18.7746 -18.4368 -18.4198 -16.7744 -16.7155 -16.5651 -16.5532 -16.3581 -16.3052 -10.1140 -9.8022 -8.4685 -8.0313 0.9163 1.0055 4.3683 4.4220 5.2095 5.5879 6.4447 6.5651 12.1532 12.3254 13.3599 13.4290 13.7593 13.8757 k = 0.1439-0.2458-0.4703 ( 3015 PWs) bands (ev): ************************************-176.0448-176.0323-138.2953-138.2814 -92.7521 -92.7521 -64.3602 -64.3581 -63.4846 -63.4833 -61.5170 -61.5147 -50.8665 -50.8564 -18.7880 -18.7725 -18.4224 -18.4047 -16.7754 -16.7197 -16.5665 -16.5554 -16.3399 -16.2889 -10.0510 -9.7211 -8.4627 -8.0102 0.9240 1.0152 4.2593 4.3091 5.2797 5.6482 6.2905 6.4147 12.1260 12.2784 13.2839 13.3853 13.6874 13.8249 k = 0.1484-0.2535-0.4850 ( 3013 PWs) bands (ev): ************************************-176.0441-176.0309-138.2947-138.2799 -92.7514 -92.7514 -64.3614 -64.3594 -63.4861 -63.4847 -61.5166 -61.5144 -50.8347 -50.8290 -18.7915 -18.7754 -18.4140 -18.3956 -16.7780 -16.7256 -16.5650 -16.5552 -16.3220 -16.2732 -9.9879 -9.6389 -8.4724 -7.9969 0.9255 1.0183 4.1544 4.2040 5.3471 5.7017 6.1377 6.2711 12.0861 12.2185 13.2103 13.3414 13.6227 13.7780 k = 0.1529-0.2612-0.4997 ( 3007 PWs) bands (ev): ************************************-176.0394-176.0288-138.2871-138.2767 -92.7500 -92.7500 -64.3625 -64.3604 -63.4873 -63.4859 -61.5163 -61.5141 -50.7590 -50.7498 -18.7923 -18.7759 -18.3972 -18.3783 -16.7786 -16.7289 -16.5679 -16.5581 -16.3028 -16.2559 -9.9237 -9.5543 -8.4663 -7.9719 0.9218 1.0160 4.0571 4.1080 5.4131 5.7420 5.9900 6.1490 12.0344 12.1482 13.1404 13.2937 13.5678 13.7369 k = 0.1574-0.2689-0.5144 ( 3007 PWs) bands (ev): ************************************-176.0409-176.0297-138.2901-138.2757 -92.7496 -92.7496 -64.3639 -64.3617 -63.4888 -63.4873 -61.5160 -61.5138 -50.7678 -50.7606 -18.7966 -18.7796 -18.3890 -18.3695 -16.7832 -16.7366 -16.5720 -16.5623 -16.2830 -16.2384 -9.8612 -9.4687 -8.4787 -7.9612 0.9111 1.0063 3.9662 4.0206 5.4625 5.7320 5.8530 6.0728 11.9710 12.0682 13.0714 13.2358 13.5240 13.7024 k = 0.1619-0.2765-0.5291 ( 3010 PWs) bands (ev): ************************************-176.0435-176.0315-138.2922-138.2784 -92.7497 -92.7497 -64.3653 -64.3631 -63.4905 -63.4889 -61.5159 -61.5137 -50.7929 -50.7846 -18.8020 -18.7846 -18.3816 -18.3615 -16.7897 -16.7456 -16.5775 -16.5673 -16.2674 -16.2250 -9.8007 -9.3814 -8.4964 -7.9497 0.8930 0.9888 3.8834 3.9421 5.4746 5.6486 5.7596 6.0686 11.8979 11.9811 13.0021 13.1674 13.4904 13.6761 k = 0.1664-0.2842-0.5438 ( 3008 PWs) bands (ev): ************************************-176.0418-176.0301-138.2885-138.2748 -92.7491 -92.7491 -64.3666 -64.3643 -63.4919 -63.4902 -61.5155 -61.5133 -50.7555 -50.7472 -18.8038 -18.7858 -18.3735 -18.3526 -16.7948 -16.7533 -16.5799 -16.5685 -16.2464 -16.2064 -9.7365 -9.2915 -8.4981 -7.9256 0.8680 0.9640 3.8106 3.8737 5.4113 5.5196 5.7529 6.1127 11.8178 11.8899 12.9300 13.0907 13.4650 13.6588 k = 0.1709-0.2919-0.5585 ( 3014 PWs) bands (ev): ************************************-176.0455-176.0341-138.2934-138.2801 -92.7497 -92.7497 -64.3681 -64.3657 -63.4937 -63.4919 -61.5154 -61.5132 -50.8396 -50.8385 -18.8102 -18.7917 -18.3696 -18.3481 -16.8034 -16.7643 -16.5866 -16.5746 -16.2324 -16.1944 -9.6778 -9.2008 -8.5221 -7.9149 0.8348 0.9303 3.7450 3.8136 5.2945 5.3768 5.7947 6.1676 11.7306 11.7932 12.8529 13.0057 13.4451 13.6489 k = 0.1753-0.2996-0.5731 ( 3010 PWs) bands (ev): ************************************-176.0439-176.0322-138.2900-138.2785 -92.7486 -92.7486 -64.3692 -64.3668 -63.4950 -63.4931 -61.5151 -61.5129 -50.8176 -50.8161 -18.8097 -18.7905 -18.3605 -18.3382 -16.8056 -16.7682 -16.5870 -16.5745 -16.2148 -16.1787 -9.6155 -9.1068 -8.5228 -7.8883 0.7949 0.8895 3.6889 3.7623 5.1644 5.2328 5.8590 6.2366 11.6412 11.6970 12.7710 12.9157 13.4302 13.6459 k = 0.1798-0.3073-0.5878 ( 3010 PWs) bands (ev): ************************************-176.0432-176.0320-138.2908-138.2786 -92.7483 -92.7483 -64.3705 -64.3681 -63.4965 -63.4945 -61.5148 -61.5126 -50.8246 -50.8194 -18.8119 -18.7922 -18.3544 -18.3314 -16.8089 -16.7732 -16.5915 -16.5781 -16.1982 -16.1638 -9.5566 -9.0121 -8.5307 -7.8640 0.7474 0.8404 3.6397 3.7175 5.0333 5.0902 5.9293 6.3071 11.5480 11.5985 12.6831 12.8202 13.4189 13.6475 k = 0.1843-0.3150-0.6025 ( 3008 PWs) bands (ev): ************************************-176.0424-176.0318-138.2900-138.2783 -92.7476 -92.7476 -64.3717 -64.3692 -63.4978 -63.4957 -61.5146 -61.5125 -50.8201 -50.8150 -18.8118 -18.7916 -18.3438 -18.3202 -16.8139 -16.7797 -16.5959 -16.5815 -16.1816 -16.1491 -9.4986 -8.9164 -8.5361 -7.8342 0.6931 0.7840 3.5951 3.6775 4.9076 4.9524 6.0025 6.3803 11.4546 11.5008 12.5897 12.7207 13.4106 13.6521 k = 0.1888-0.3226-0.6172 ( 3002 PWs) bands (ev): ************************************-176.0394-176.0282-138.2867-138.2738 -92.7462 -92.7462 -64.3727 -64.3702 -63.4990 -63.4968 -61.5141 -61.5121 -50.7570 -50.7520 -18.8084 -18.7874 -18.3361 -18.3114 -16.8173 -16.7847 -16.5912 -16.5763 -16.1643 -16.1336 -9.4386 -8.8200 -8.5348 -7.7958 0.6331 0.7213 3.5532 3.6402 4.7913 4.8227 6.0793 6.4563 11.3632 11.4059 12.4914 12.6181 13.4049 13.6588 k = 0.1933-0.3303-0.6319 ( 3002 PWs) bands (ev): ************************************-176.0395-176.0289-138.2866-138.2745 -92.7458 -92.7458 -64.3739 -64.3714 -63.5004 -63.4981 -61.5139 -61.5119 -50.7558 -50.7508 -18.8082 -18.7864 -18.3304 -18.3049 -16.8218 -16.7904 -16.5961 -16.5803 -16.1492 -16.1201 -9.3851 -8.7256 -8.5371 -7.7610 0.5667 0.6517 3.5092 3.6010 4.6854 4.7044 6.1541 6.5306 11.2707 11.3109 12.3882 12.5118 13.4003 13.6659 k = 0.1978-0.3380-0.6466 ( 3002 PWs) bands (ev): ************************************-176.0413-176.0299-138.2860-138.2759 -92.7454 -92.7454 -64.3751 -64.3724 -63.5017 -63.4993 -61.5138 -61.5118 -50.7572 -50.7491 -18.8075 -18.7852 -18.3231 -18.2968 -16.8285 -16.7983 -16.6012 -16.5847 -16.1333 -16.1059 -9.3350 -8.6406 -8.5287 -7.7238 0.4957 0.5770 3.4597 3.5569 4.5870 4.6085 6.2293 6.6053 11.1795 11.2185 12.2810 12.4028 13.3966 13.6730 k = 0.2023-0.3457-0.6613 ( 3002 PWs) bands (ev): ************************************-176.0417-176.0313-138.2840-138.2772 -92.7450 -92.7450 -64.3763 -64.3735 -63.5030 -63.5005 -61.5136 -61.5116 -50.7632 -50.7577 -18.8096 -18.7867 -18.3159 -18.2889 -16.8313 -16.8020 -16.6084 -16.5907 -16.1171 -16.0912 -9.2845 -8.5919 -8.4807 -7.6822 0.4206 0.4975 3.4003 3.5043 4.4988 4.5395 6.3032 6.6787 11.0913 11.1294 12.1704 12.2920 13.3932 13.6795 k = 0.2068-0.3534-0.6760 ( 3004 PWs) bands (ev): ************************************-176.0430-176.0325-138.2846-138.2814 -92.7450 -92.7450 -64.3775 -64.3747 -63.5045 -63.5018 -61.5133 -61.5115 -50.7845 -50.7754 -18.8069 -18.7829 -18.3186 -18.2904 -16.8338 -16.8049 -16.6125 -16.5938 -16.1070 -16.0824 -9.2430 -8.5899 -8.3928 -7.6388 0.3431 0.4151 3.3281 3.4396 4.4296 4.4937 6.3757 6.7498 11.0055 11.0442 12.0569 12.1786 13.3895 13.6848 k = 0.2113-0.3610-0.6907 ( 2998 PWs) bands (ev): ************************************-176.0382-176.0313-138.2810-138.2794 -92.7436 -92.7436 -64.3784 -64.3755 -63.5054 -63.5027 -61.5131 -61.5113 -50.7509 -50.7443 -18.8007 -18.7759 -18.3096 -18.2804 -16.8374 -16.8093 -16.6126 -16.5932 -16.0923 -16.0692 -9.1994 -8.5846 -8.2932 -7.5846 0.2644 0.3317 3.2425 3.3614 4.3843 4.4707 6.4491 6.8225 10.9232 10.9649 11.9416 12.0643 13.3857 13.6886 k = 0.2158-0.3687-0.7054 ( 3002 PWs) bands (ev): ************************************-176.0425-176.0333-138.2841-138.2817 -92.7439 -92.7439 -64.3796 -64.3767 -63.5068 -63.5039 -61.5130 -61.5113 -50.7763 -50.7701 -18.8008 -18.7751 -18.3093 -18.2791 -16.8438 -16.8164 -16.6212 -16.6009 -16.0798 -16.0581 -9.1661 -8.5931 -8.1920 -7.5341 0.1826 0.2445 3.1440 3.2690 4.3589 4.4661 6.5188 6.8898 10.8435 10.8894 11.8238 11.9481 13.3803 13.6903 k = 0.2203-0.3764-0.7201 ( 3002 PWs) bands (ev): ************************************-176.0429-176.0331-138.2859-138.2798 -92.7436 -92.7435 -64.3806 -64.3776 -63.5080 -63.5050 -61.5128 -61.5111 -50.7727 -50.7646 -18.7985 -18.7719 -18.3072 -18.2759 -16.8457 -16.8186 -16.6268 -16.6054 -16.0681 -16.0478 -9.1332 -8.5952 -8.0894 -7.4760 0.1010 0.1573 3.0353 3.1649 4.3530 4.4785 6.5878 6.9585 10.7684 10.8201 11.7049 11.8315 13.3741 13.6901 k = 0.2248-0.3841-0.7348 ( 3002 PWs) bands (ev): ************************************-176.0454-176.0321-138.2858-138.2790 -92.7432 -92.7432 -64.3816 -64.3785 -63.5090 -63.5059 -61.5127 -61.5111 -50.7555 -50.7487 -18.7955 -18.7680 -18.3041 -18.2717 -16.8476 -16.8204 -16.6333 -16.6107 -16.0583 -16.0391 -9.1030 -8.5955 -7.9865 -7.4151 0.0199 0.0702 2.9186 3.0513 4.3630 4.5040 6.6551 7.0254 10.6972 10.7568 11.5850 11.7147 13.3666 13.6875 k = 0.2293-0.3918-0.7495 ( 2998 PWs) bands (ev): ************************************-176.0434-176.0289-138.2827-138.2751 -92.7422 -92.7422 -64.3824 -64.3793 -63.5100 -63.5068 -61.5124 -61.5109 -50.7048 -50.6986 -18.7899 -18.7613 -18.3011 -18.2675 -16.8447 -16.8174 -16.6378 -16.6137 -16.0470 -16.0289 -9.0692 -8.5871 -7.8829 -7.3474 -0.0598 -0.0155 2.7964 2.9312 4.3864 4.5416 6.7208 7.0916 10.6325 10.7020 11.4654 11.5988 13.3577 13.6827 k = 0.2338-0.3995-0.7642 ( 2994 PWs) bands (ev): ************************************-176.0424-176.0259-138.2828-138.2689 -92.7412 -92.7412 -64.3832 -64.3801 -63.5109 -63.5076 -61.5121 -61.5106 -50.6792 -50.6722 -18.7842 -18.7546 -18.2983 -18.2635 -16.8443 -16.8169 -16.6420 -16.6166 -16.0331 -16.0163 -9.0398 -8.5809 -7.7799 -7.2784 -0.1376 -0.0994 2.6704 2.8064 4.4189 4.5869 6.7839 7.1544 10.5727 10.6530 11.3451 11.4822 13.3470 13.6751 k = 0.2383-0.4071-0.7789 ( 2992 PWs) bands (ev): ************************************-176.0380-176.0245-138.2791-138.2686 -92.7406 -92.7406 -64.3841 -64.3808 -63.5118 -63.5084 -61.5119 -61.5105 -50.6763 -50.6686 -18.7806 -18.7500 -18.2961 -18.2602 -16.8431 -16.8154 -16.6450 -16.6185 -16.0250 -16.0092 -9.0141 -8.5769 -7.6774 -7.2088 -0.2135 -0.1815 2.5422 2.6788 4.4590 4.6398 6.8440 7.2137 10.5180 10.6103 11.2245 11.3664 13.3343 13.6648 k = 0.2428-0.4148-0.7936 ( 2990 PWs) bands (ev): ************************************-176.0375-176.0226-138.2777-138.2671 -92.7400 -92.7400 -64.3849 -64.3815 -63.5127 -63.5091 -61.5118 -61.5104 -50.6826 -50.6749 -18.7733 -18.7413 -18.2954 -18.2580 -16.8466 -16.8189 -16.6498 -16.6224 -16.0137 -15.9989 -8.9924 -8.5744 -7.5768 -7.1387 -0.2866 -0.2599 2.4127 2.5499 4.5039 4.6963 6.9020 7.2695 10.4685 10.5749 11.1046 11.2521 13.3199 13.6518 k = 0.2473-0.4225-0.8083 ( 2988 PWs) bands (ev): ************************************-176.0363-176.0213-138.2759-138.2662 -92.7394 -92.7394 -64.3856 -64.3822 -63.5135 -63.5098 -61.5116 -61.5103 -50.6842 -50.6743 -18.7674 -18.7344 -18.2934 -18.2548 -16.8476 -16.8195 -16.6560 -16.6272 -16.0042 -15.9904 -8.9735 -8.5719 -7.4776 -7.0671 -0.3566 -0.3344 2.2831 2.4204 4.5527 4.7566 6.9576 7.3214 10.4244 10.5450 10.9857 11.1395 13.3035 13.6360 k = 0.2518-0.4302-0.8230 ( 2986 PWs) bands (ev): ************************************-176.0358-176.0192-138.2768-138.2622 -92.7388 -92.7388 -64.3863 -64.3828 -63.5142 -63.5105 -61.5114 -61.5102 -50.6572 -50.6490 -18.7580 -18.7231 -18.2977 -18.2570 -16.8469 -16.8180 -16.6614 -16.6311 -15.9957 -15.9828 -8.9572 -8.5674 -7.3804 -6.9954 -0.4235 -0.4034 2.1539 2.2914 4.6035 4.8187 7.0113 7.3717 10.3864 10.5220 10.8688 11.0304 13.2854 13.6179 k = 0.2563-0.4379-0.8377 ( 2990 PWs) bands (ev): ************************************-176.0388-176.0211-138.2818-138.2634 -92.7393 -92.7393 -64.3872 -64.3837 -63.5152 -63.5114 -61.5114 -61.5102 -50.6964 -50.6891 -18.7572 -18.7209 -18.3032 -18.2610 -16.8486 -16.8189 -16.6680 -16.6363 -15.9905 -15.9784 -8.9540 -8.5747 -7.2866 -6.9265 -0.4881 -0.4670 2.0255 2.1629 4.6549 4.8810 7.0625 7.4162 10.3512 10.4996 10.7537 10.9245 13.2649 13.5968 k = 0.2608-0.4455-0.8524 ( 2990 PWs) bands (ev): ************************************-176.0405-176.0196-138.2840-138.2609 -92.7391 -92.7391 -64.3879 -64.3843 -63.5160 -63.5121 -61.5112 -61.5102 -50.6972 -50.6860 -18.7515 -18.7135 -18.3072 -18.2632 -16.8484 -16.8177 -16.6742 -16.6407 -15.9838 -15.9726 -8.9433 -8.5744 -7.1950 -6.8569 -0.5487 -0.5235 1.8986 2.0361 4.7068 4.9439 7.1125 7.4598 10.3220 10.4781 10.6430 10.8278 13.2428 13.5737 k = 0.2653-0.4532-0.8671 ( 2992 PWs) bands (ev): ************************************-176.0401-176.0211-138.2807-138.2618 -92.7393 -92.7393 -64.3887 -64.3850 -63.5168 -63.5128 -61.5111 -61.5101 -50.6999 -50.6868 -18.7495 -18.7102 -18.3121 -18.2666 -16.8488 -16.8171 -16.6800 -16.6449 -15.9768 -15.9665 -8.9320 -8.5756 -7.1077 -6.7871 -0.6050 -0.5739 1.7736 1.9114 4.7575 5.0056 7.1616 7.5021 10.2953 10.4448 10.5401 10.7476 13.2188 13.5482 k = 0.2698-0.4609-0.8818 ( 2990 PWs) bands (ev): ************************************-176.0377-176.0195-138.2779-138.2605 -92.7388 -92.7388 -64.3893 -64.3855 -63.5174 -63.5133 -61.5109 -61.5100 -50.6688 -50.6568 -18.7411 -18.6996 -18.3173 -18.2694 -16.8464 -16.8132 -16.6852 -16.6481 -15.9708 -15.9613 -8.9190 -8.5698 -7.0234 -6.7191 -0.6548 -0.6167 1.6510 1.7893 4.8074 5.0666 7.2099 7.5437 10.2671 10.3885 10.4537 10.6952 13.1936 13.5211 k = 0.2743-0.4686-0.8965 ( 2990 PWs) bands (ev): ************************************-176.0375-176.0182-138.2779-138.2599 -92.7386 -92.7386 -64.3899 -64.3861 -63.5181 -63.5139 -61.5106 -61.5098 -50.6745 -50.6627 -18.7350 -18.6910 -18.3266 -18.2762 -16.8457 -16.8109 -16.6913 -16.6521 -15.9615 -15.9527 -8.9135 -8.5688 -6.9436 -6.6542 -0.6988 -0.6532 1.5309 1.6696 4.8544 5.1240 7.2575 7.5828 10.2204 10.3241 10.3760 10.6733 13.1666 13.4923 k = 0.2788-0.4763-0.9112 ( 2980 PWs) bands (ev): ************************************-176.0296-176.0121-138.2679-138.2523 -92.7368 -92.7368 -64.3901 -64.3863 -63.5183 -63.5141 -61.5102 -61.5094 -50.5529 -50.5382 -18.7204 -18.6736 -18.3290 -18.2756 -16.8395 -16.8022 -16.6953 -16.6531 -15.9484 -15.9401 -8.8895 -8.5458 -6.8674 -6.5886 -0.7350 -0.6817 1.4140 1.5537 4.8990 5.1796 7.3061 7.6258 10.1438 10.2687 10.3205 10.6796 13.1394 13.4628 k = 0.2833-0.4840-0.9259 ( 2984 PWs) bands (ev): ************************************-176.0332-176.0167-138.2698-138.2572 -92.7373 -92.7373 -64.3907 -64.3868 -63.5189 -63.5146 -61.5103 -61.5096 -50.6192 -50.6019 -18.7137 -18.6642 -18.3376 -18.2814 -16.8440 -16.8057 -16.7021 -16.6585 -15.9474 -15.9398 -8.8935 -8.5559 -6.7981 -6.5314 -0.7655 -0.7047 1.2999 1.4400 4.9389 5.2284 7.3540 7.6629 10.0505 10.1827 10.2988 10.6954 13.1093 13.4315 k = 0.2878-0.4916-0.9405 ( 2980 PWs) bands (ev): ************************************-176.0298-176.0140-138.2650-138.2552 -92.7365 -92.7365 -64.3911 -64.3871 -63.5192 -63.5148 -61.5101 -61.5095 -50.5774 -50.5570 -18.7038 -18.6510 -18.3447 -18.2852 -16.8400 -16.8000 -16.7029 -16.6573 -15.9437 -15.9368 -8.8830 -8.5467 -6.7333 -6.4763 -0.7876 -0.7193 1.1899 1.3309 4.9754 5.2741 7.4037 7.7032 9.9558 10.0928 10.2948 10.7236 13.0791 13.3998 k = 0.2922-0.4993-0.9552 ( 2984 PWs) bands (ev): ************************************-176.0334-176.0166-138.2695-138.2599 -92.7370 -92.7370 -64.3916 -64.3876 -63.5197 -63.5153 -61.5102 -61.5096 -50.6610 -50.6408 -18.6982 -18.6421 -18.3552 -18.2922 -16.8455 -16.8056 -16.7078 -16.6620 -15.9401 -15.9339 -8.8912 -8.5600 -6.6761 -6.4293 -0.8033 -0.7283 1.0833 1.2255 5.0070 5.3121 7.4535 7.7405 9.8622 10.0010 10.2936 10.7537 13.0470 13.3671 k = 0.2967-0.5070-0.9699 ( 2986 PWs) bands (ev): ************************************-176.0343-176.0190-138.2712-138.2616 -92.7373 -92.7373 -64.3921 -64.3880 -63.5202 -63.5157 -61.5101 -61.5096 -50.6776 -50.6600 -18.6936 -18.6344 -18.3647 -18.2985 -16.8449 -16.8026 -16.7136 -16.6652 -15.9387 -15.9330 -8.8940 -8.5629 -6.6239 -6.3845 -0.8117 -0.7308 0.9819 1.1253 5.0341 5.3446 7.5047 7.7808 9.7723 9.9120 10.2977 10.7893 13.0147 13.3345 k = 0.3012-0.5147-0.9846 ( 2988 PWs) bands (ev): ************************************-176.0369-176.0217-138.2739-138.2651 -92.7375 -92.7375 -64.3924 -64.3884 -63.5205 -63.5160 -61.5101 -61.5097 -50.7286 -50.7189 -18.6872 -18.6244 -18.3735 -18.3037 -16.8478 -16.8040 -16.7199 -16.6698 -15.9357 -15.9305 -8.9015 -8.5708 -6.5782 -6.3455 -0.8132 -0.7273 0.8857 1.0308 5.0563 5.3704 7.5564 7.8204 9.6870 9.8260 10.3040 10.8267 12.9818 13.3016 k = 0.3057-0.5224-0.9993 ( 2986 PWs) bands (ev): ************************************-176.0365-176.0199-138.2732-138.2629 -92.7371 -92.7371 -64.3927 -64.3886 -63.5206 -63.5161 -61.5101 -61.5097 -50.7170 -50.7012 -18.6799 -18.6138 -18.3784 -18.3052 -16.8468 -16.8008 -16.7249 -16.6723 -15.9320 -15.9273 -8.8958 -8.5666 -6.5389 -6.3098 -0.8077 -0.7179 0.7964 0.9436 5.0741 5.3911 7.6080 7.8626 9.6091 9.7474 10.3137 10.8675 12.9495 13.2692 k = 0.3102-0.5300-1.0140 ( 2988 PWs) bands (ev): ************************************-176.0381-176.0203-138.2748-138.2634 -92.7373 -92.7373 -64.3930 -64.3889 -63.5209 -63.5163 -61.5101 -61.5098 -50.7228 -50.7071 -18.6745 -18.6041 -18.3880 -18.3106 -16.8477 -16.7992 -16.7319 -16.6766 -15.9306 -15.9263 -8.8967 -8.5675 -6.5062 -6.2811 -0.7971 -0.7051 0.7146 0.8641 5.0869 5.4048 7.6584 7.9027 9.5388 9.6747 10.3248 10.9070 12.9171 13.2370 k = 0.3147-0.5377-1.0287 ( 2986 PWs) bands (ev): ************************************-176.0391-176.0168-138.2737-138.2604 -92.7369 -92.7369 -64.3931 -64.3890 -63.5209 -63.5163 -61.5100 -61.5097 -50.6923 -50.6752 -18.6675 -18.5927 -18.3959 -18.3140 -16.8453 -16.7947 -16.7341 -16.6765 -15.9290 -15.9252 -8.8908 -8.5610 -6.4796 -6.2565 -0.7821 -0.6895 0.6419 0.7944 5.0952 5.4127 7.7062 7.9419 9.4777 9.6105 10.3377 10.9479 12.8855 13.2054 k = 0.3192-0.5454-1.0434 ( 2978 PWs) bands (ev): ************************************-176.0347-176.0128-138.2687-138.2542 -92.7355 -92.7355 -64.3930 -64.3889 -63.5207 -63.5161 -61.5098 -61.5095 -50.6095 -50.5900 -18.6552 -18.5744 -18.4024 -18.3144 -16.8411 -16.7892 -16.7318 -16.6729 -15.9250 -15.9216 -8.8790 -8.5467 -6.4583 -6.2363 -0.7632 -0.6722 0.5805 0.7369 5.0999 5.4155 7.7503 7.9788 9.4281 9.5563 10.3521 10.9879 12.8548 13.1745 k = 0.3237-0.5531-1.0581 ( 2978 PWs) bands (ev): ************************************-176.0347-176.0126-138.2687-138.2537 -92.7355 -92.7355 -64.3932 -64.3891 -63.5207 -63.5161 -61.5098 -61.5095 -50.6099 -50.5902 -18.6510 -18.5656 -18.4106 -18.3180 -16.8416 -16.7898 -16.7318 -16.6729 -15.9242 -15.9212 -8.8777 -8.5458 -6.4440 -6.2240 -0.7460 -0.6591 0.5322 0.6922 5.0999 5.4120 7.7873 8.0080 9.3902 9.5128 10.3667 11.0231 12.8247 13.1440 k = 0.3282-0.5608-1.0728 ( 2970 PWs) bands (ev): ************************************-176.0312-176.0072-138.2639-138.2454 -92.7341 -92.7341 -64.3930 -64.3889 -63.5204 -63.5157 -61.5096 -61.5094 -50.5018 -50.4856 -18.6422 -18.5534 -18.4100 -18.3140 -16.8391 -16.7891 -16.7254 -16.6683 -15.9211 -15.9185 -8.8615 -8.5270 -6.4344 -6.2151 -0.7307 -0.6499 0.5002 0.6643 5.0967 5.4050 7.8170 8.0317 9.3674 9.4843 10.3838 11.0593 12.7971 13.1149 k = 0.3327-0.5685-1.0875 ( 2962 PWs) bands (ev): ************************************-176.0265-176.0033-138.2604-138.2358 -92.7327 -92.7327 -64.3928 -64.3887 -63.5199 -63.5153 -61.5096 -61.5094 -50.4218 -50.4036 -18.6323 -18.5403 -18.4077 -18.3084 -16.8398 -16.7921 -16.7208 -16.6660 -15.9160 -15.9137 -8.8450 -8.5096 -6.4305 -6.2115 -0.7212 -0.6482 0.4864 0.6550 5.0903 5.3936 7.8355 8.0464 9.3594 9.4697 10.4012 11.0922 12.7706 13.0864 k = 0.3372-0.5761-1.1022 ( 2962 PWs) bands (ev): ************************************-176.0267-176.0028-138.2604-138.2352 -92.7327 -92.7327 -64.3929 -64.3887 -63.5198 -63.5152 -61.5096 -61.5093 -50.4225 -50.4041 -18.6314 -18.5382 -18.4098 -18.3093 -16.8418 -16.7967 -16.7160 -16.6639 -15.9160 -15.9141 -8.8435 -8.5093 -6.4324 -6.2153 -0.7209 -0.6564 0.4926 0.6647 5.0806 5.3770 7.8418 8.0491 9.3653 9.4688 10.4185 11.1183 12.7450 13.0580 k = 0.3417-0.5838-1.1169 ( 2972 PWs) bands (ev): ************************************-176.0315-176.0068-138.2701-138.2397 -92.7345 -92.7345 -64.3934 -64.3892 -63.5202 -63.5156 -61.5096 -61.5094 -50.5091 -50.4901 -18.6414 -18.5491 -18.4183 -18.3188 -16.8449 -16.8023 -16.7115 -16.6619 -15.9227 -15.9209 -8.8601 -8.5269 -6.4401 -6.2262 -0.7323 -0.6757 0.5194 0.6943 5.0679 5.3553 7.8356 8.0388 9.3843 9.4807 10.4362 11.1381 12.7203 13.0295 k = 0.6583-0.4482-1.0348 ( 2972 PWs) bands (ev): ************************************-176.0324-176.0124-138.2597-138.2524 -92.7345 -92.7345 -64.3930 -64.3889 -63.5206 -63.5159 -61.5096 -61.5094 -50.4751 -50.4590 -18.6436 -18.5538 -18.4148 -18.3177 -16.8400 -16.7904 -16.7241 -16.6677 -15.9216 -15.9193 -8.8464 -8.5356 -6.4438 -6.2331 -0.7174 -0.6455 0.4898 0.6332 5.0962 5.4363 7.8079 8.1818 9.4336 9.5735 10.5398 10.9095 12.6953 12.8274 k = 0.6538-0.4316-1.0348 ( 2974 PWs) bands (ev): ************************************-176.0323-176.0143-138.2611-138.2545 -92.7349 -92.7349 -64.3929 -64.3888 -63.5207 -63.5161 -61.5096 -61.5094 -50.4861 -50.4723 -18.6484 -18.5622 -18.4111 -18.3176 -16.8402 -16.7911 -16.7234 -16.6676 -15.9227 -15.9206 -8.8491 -8.5424 -6.4563 -6.2488 -0.7231 -0.6525 0.5309 0.6635 5.0823 5.4155 7.8184 8.1571 9.4487 9.6040 10.5558 10.9374 12.6737 12.7986 k = 0.6492-0.4149-1.0348 ( 2976 PWs) bands (ev): ************************************-176.0334-176.0168-138.2638-138.2560 -92.7353 -92.7352 -64.3927 -64.3886 -63.5208 -63.5162 -61.5097 -61.5095 -50.5114 -50.4951 -18.6541 -18.5727 -18.4037 -18.3150 -16.8421 -16.7952 -16.7215 -16.6681 -15.9231 -15.9213 -8.8536 -8.5532 -6.4731 -6.2675 -0.7416 -0.6696 0.5931 0.7163 5.0668 5.3924 7.8170 8.1233 9.4715 9.6499 10.5717 10.9642 12.6541 12.7719 k = 0.6447-0.3982-1.0348 ( 2980 PWs) bands (ev): ************************************-176.0365-176.0195-138.2662-138.2597 -92.7360 -92.7360 -64.3926 -64.3885 -63.5210 -63.5164 -61.5098 -61.5095 -50.5430 -50.5229 -18.6630 -18.5870 -18.3971 -18.3139 -16.8451 -16.8003 -16.7188 -16.6676 -15.9246 -15.9229 -8.8586 -8.5626 -6.4930 -6.2907 -0.7720 -0.6966 0.6744 0.7902 5.0497 5.3662 7.8050 8.0824 9.5024 9.7070 10.5886 10.9897 12.6378 12.7486 k = 0.6402-0.3815-1.0348 ( 2978 PWs) bands (ev): ************************************-176.0348-176.0175-138.2654-138.2584 -92.7357 -92.7357 -64.3923 -64.3882 -63.5209 -63.5163 -61.5098 -61.5095 -50.5214 -50.5006 -18.6685 -18.5982 -18.3838 -18.3063 -16.8457 -16.8040 -16.7121 -16.6641 -15.9243 -15.9228 -8.8554 -8.5626 -6.5156 -6.3162 -0.8099 -0.7303 0.7726 0.8827 5.0325 5.3394 7.7844 8.0373 9.5411 9.7718 10.6072 11.0166 12.6250 12.7293 k = 0.6357-0.3648-1.0348 ( 2982 PWs) bands (ev): ************************************-176.0357-176.0201-138.2700-138.2589 -92.7364 -92.7364 -64.3921 -64.3881 -63.5210 -63.5165 -61.5098 -61.5095 -50.5632 -50.5444 -18.6803 -18.6154 -18.3753 -18.3034 -16.8483 -16.8091 -16.7065 -16.6613 -15.9273 -15.9260 -8.8594 -8.5715 -6.5409 -6.3450 -0.8546 -0.7711 0.8850 0.9904 5.0145 5.3104 7.7551 7.9865 9.5849 9.8396 10.6275 11.0414 12.6153 12.7141 k = 0.6312-0.3482-1.0348 ( 2988 PWs) bands (ev): ************************************-176.0388-176.0236-138.2732-138.2623 -92.7375 -92.7375 -64.3920 -64.3881 -63.5211 -63.5166 -61.5100 -61.5097 -50.6396 -50.6194 -18.6932 -18.6336 -18.3664 -18.2997 -16.8539 -16.8171 -16.7055 -16.6627 -15.9286 -15.9275 -8.8636 -8.5818 -6.5692 -6.3768 -0.9039 -0.8176 1.0094 1.1108 4.9964 5.2803 7.7183 7.9323 9.6311 9.9068 10.6502 11.0658 12.6091 12.7037 k = 0.6266-0.3315-1.0348 ( 2992 PWs) bands (ev): ************************************-176.0422-176.0272-138.2786-138.2724 -92.7382 -92.7382 -64.3917 -64.3877 -63.5209 -63.5165 -61.5104 -61.5101 -50.6368 -50.6207 -18.7028 -18.6481 -18.3520 -18.2904 -16.8570 -16.8228 -16.6985 -16.6585 -15.9428 -15.9420 -8.8840 -8.5972 -6.5980 -6.4110 -0.9552 -0.8669 1.1444 1.2416 4.9791 5.2486 7.6773 7.8764 9.6790 9.9711 10.6763 11.0885 12.6068 12.7001 k = 0.6221-0.3148-1.0348 ( 2988 PWs) bands (ev): ************************************-176.0406-176.0242-138.2780-138.2653 -92.7376 -92.7376 -64.3912 -64.3873 -63.5206 -63.5163 -61.5104 -61.5100 -50.6227 -50.6085 -18.7107 -18.6604 -18.3358 -18.2787 -16.8600 -16.8296 -16.6837 -16.6478 -15.9439 -15.9432 -8.8741 -8.5939 -6.6274 -6.4447 -1.0072 -0.9175 1.2884 1.3822 4.9631 5.2184 7.6347 7.8205 9.7263 10.0303 10.7069 11.1161 12.6107 12.7044 k = 0.6176-0.2981-1.0348 ( 2990 PWs) bands (ev): ************************************-176.0412-176.0254-138.2800-138.2660 -92.7380 -92.7380 -64.3909 -64.3871 -63.5205 -63.5162 -61.5105 -61.5101 -50.6578 -50.6461 -18.7226 -18.6766 -18.3219 -18.2691 -16.8653 -16.8366 -16.6803 -16.6463 -15.9447 -15.9441 -8.8736 -8.6007 -6.6589 -6.4803 -1.0604 -0.9702 1.4393 1.5292 4.9473 5.1882 7.5884 7.7629 9.7706 10.0808 10.7415 11.1413 12.6194 12.7164 k = 0.6131-0.2814-1.0348 ( 2986 PWs) bands (ev): ************************************-176.0389-176.0227-138.2754-138.2652 -92.7374 -92.7374 -64.3903 -64.3866 -63.5201 -63.5159 -61.5105 -61.5101 -50.6480 -50.6369 -18.7313 -18.6893 -18.3019 -18.2532 -16.8690 -16.8424 -16.6727 -16.6410 -15.9432 -15.9427 -8.8649 -8.5978 -6.6905 -6.5159 -1.1123 -1.0221 1.5964 1.6823 4.9337 5.1596 7.5422 7.7066 9.8112 10.1229 10.7798 11.1671 12.6353 12.7380 k = 0.6085-0.2648-1.0348 ( 2988 PWs) bands (ev): ************************************-176.0390-176.0247-138.2760-138.2683 -92.7378 -92.7378 -64.3900 -64.3863 -63.5200 -63.5159 -61.5106 -61.5102 -50.6598 -50.6507 -18.7443 -18.7055 -18.2905 -18.2452 -16.8734 -16.8486 -16.6657 -16.6362 -15.9453 -15.9449 -8.8670 -8.6074 -6.7231 -6.5532 -1.1641 -1.0747 1.7581 1.8398 4.9215 5.1306 7.4944 7.6496 9.8451 10.1547 10.8197 11.1903 12.6586 12.7691 k = 0.6040-0.2481-1.0348 ( 2996 PWs) bands (ev): ************************************-176.0439-176.0285-138.2799-138.2726 -92.7394 -92.7394 -64.3900 -64.3864 -63.5201 -63.5161 -61.5107 -61.5103 -50.7150 -50.7056 -18.7645 -18.7289 -18.2826 -18.2406 -16.8787 -16.8554 -16.6633 -16.6356 -15.9483 -15.9479 -8.8730 -8.6207 -6.7574 -6.5927 -1.2160 -1.1280 1.9234 2.0006 4.9113 5.1022 7.4446 7.5915 9.8720 10.1770 10.8592 11.2110 12.6902 12.8096 k = 0.5995-0.2314-1.0348 ( 2998 PWs) bands (ev): ************************************-176.0471-176.0302-138.2874-138.2716 -92.7398 -92.7398 -64.3896 -64.3861 -63.5199 -63.5159 -61.5109 -61.5105 -50.7520 -50.7459 -18.7774 -18.7448 -18.2683 -18.2292 -16.8839 -16.8622 -16.6592 -16.6332 -15.9510 -15.9507 -8.8805 -8.6308 -6.7902 -6.6312 -1.2652 -1.1793 2.0911 2.1640 4.9046 5.0759 7.3972 7.5358 9.8920 10.1916 10.8969 11.2295 12.7317 12.8605 k = 0.5950-0.2147-1.0348 ( 2998 PWs) bands (ev): ************************************-176.0465-176.0306-138.2872-138.2720 -92.7399 -92.7399 -64.3892 -64.3858 -63.5196 -63.5158 -61.5110 -61.5105 -50.7518 -50.7468 -18.7901 -18.7601 -18.2538 -18.2176 -16.8883 -16.8680 -16.6522 -16.6280 -15.9517 -15.9514 -8.8778 -8.6361 -6.8223 -6.6684 -1.3129 -1.2290 2.2604 2.3291 4.9012 5.0526 7.3511 7.4819 9.9056 10.1991 10.9308 11.2455 12.7841 12.9219 k = 0.5905-0.1980-1.0348 ( 2996 PWs) bands (ev): ************************************-176.0443-176.0291-138.2865-138.2699 -92.7396 -92.7396 -64.3888 -64.3855 -63.5193 -63.5156 -61.5109 -61.5105 -50.7158 -50.7100 -18.8025 -18.7750 -18.2382 -18.2047 -16.8904 -16.8715 -16.6432 -16.6206 -15.9521 -15.9518 -8.8715 -8.6367 -6.8537 -6.7042 -1.3585 -1.2771 2.4298 2.4951 4.9024 5.0325 7.3071 7.4304 9.9126 10.2007 10.9599 11.2577 12.8472 12.9934 k = 0.5859-0.1814-1.0348 ( 2998 PWs) bands (ev): ************************************-176.0444-176.0286-138.2873-138.2716 -92.7400 -92.7400 -64.3884 -64.3852 -63.5190 -63.5154 -61.5111 -61.5107 -50.7050 -50.6977 -18.8193 -18.7943 -18.2214 -18.1905 -16.8917 -16.8737 -16.6382 -16.6169 -15.9584 -15.9581 -8.8682 -8.6407 -6.8845 -6.7404 -1.4029 -1.3241 2.5975 2.6609 4.9077 5.0153 7.2639 7.3797 9.9129 10.1963 10.9832 11.2631 12.9196 13.0733 k = 0.5814-0.1647-1.0348 ( 2994 PWs) bands (ev): ************************************-176.0420-176.0262-138.2823-138.2710 -92.7394 -92.7394 -64.3879 -64.3848 -63.5185 -63.5150 -61.5111 -61.5107 -50.7009 -50.6952 -18.8282 -18.8053 -18.2022 -18.1736 -16.8958 -16.8791 -16.6314 -16.6116 -15.9569 -15.9566 -8.8581 -8.6393 -6.9136 -6.7745 -1.4443 -1.3683 2.7618 2.8256 4.9195 5.0026 7.2224 7.3306 9.9071 10.1864 11.0006 11.2640 13.0003 13.1610 k = 0.5769-0.1480-1.0348 ( 2992 PWs) bands (ev): ************************************-176.0408-176.0238-138.2802-138.2642 -92.7392 -92.7392 -64.3875 -64.3845 -63.5182 -63.5149 -61.5110 -61.5105 -50.7236 -50.7108 -18.8397 -18.8186 -18.1909 -18.1642 -16.9022 -16.8870 -16.6196 -16.6017 -15.9521 -15.9518 -8.8493 -8.6359 -6.9417 -6.8085 -1.4834 -1.4103 2.9209 2.9881 4.9381 4.9951 7.1818 7.2829 9.8951 10.1714 11.0120 11.2589 13.0875 13.2552 k = 0.5724-0.1313-1.0348 ( 2994 PWs) bands (ev): ************************************-176.0432-176.0255-138.2820-138.2659 -92.7396 -92.7396 -64.3871 -64.3843 -63.5179 -63.5148 -61.5111 -61.5107 -50.7359 -50.7250 -18.8556 -18.8365 -18.1745 -18.1501 -16.9065 -16.8921 -16.6190 -16.6021 -15.9519 -15.9516 -8.8480 -8.6450 -6.9695 -6.8428 -1.5216 -1.4518 3.0720 3.1465 4.9636 4.9938 7.1434 7.2367 9.8765 10.1506 11.0179 11.2469 13.1786 13.3542 k = 0.5678-0.1146-1.0348 ( 2992 PWs) bands (ev): ************************************-176.0418-176.0245-138.2793-138.2658 -92.7394 -92.7394 -64.3867 -64.3840 -63.5175 -63.5145 -61.5111 -61.5107 -50.7348 -50.7254 -18.8651 -18.8477 -18.1595 -18.1369 -16.9104 -16.8970 -16.6129 -16.5974 -15.9515 -15.9512 -8.8405 -8.6480 -6.9951 -6.8749 -1.5564 -1.4901 3.2141 3.2993 4.9925 5.0069 7.1075 7.1932 9.8533 10.1250 11.0193 11.2312 13.2709 13.4562 k = 0.5633-0.0980-1.0348 ( 2994 PWs) bands (ev): ************************************-176.0407-176.0265-138.2794-138.2699 -92.7398 -92.7398 -64.3864 -64.3839 -63.5174 -63.5146 -61.5111 -61.5107 -50.7601 -50.7525 -18.8761 -18.8601 -18.1530 -18.1321 -16.9143 -16.9019 -16.6032 -16.5890 -15.9565 -15.9561 -8.8421 -8.6608 -7.0190 -6.9064 -1.5891 -1.5267 3.3452 3.4434 5.0116 5.0481 7.0728 7.1507 9.8240 10.0936 11.0162 11.2106 13.3605 13.5584 k = 0.5588-0.0813-1.0348 ( 2994 PWs) bands (ev): ************************************-176.0400-176.0270-138.2791-138.2703 -92.7399 -92.7399 -64.3861 -64.3837 -63.5170 -63.5144 -61.5111 -61.5107 -50.7598 -50.7536 -18.8863 -18.8717 -18.1417 -18.1226 -16.9179 -16.9065 -16.5977 -16.5846 -15.9570 -15.9568 -8.8380 -8.6680 -7.0417 -6.9362 -1.6198 -1.5612 3.4641 3.5762 5.0397 5.1040 7.0409 7.1113 9.7902 10.0569 11.0100 11.1871 13.4428 13.6573 k = 0.5543-0.0646-1.0348 ( 2990 PWs) bands (ev): ************************************-176.0364-176.0263-138.2747-138.2691 -92.7393 -92.7393 -64.3855 -64.3834 -63.5165 -63.5141 -61.5111 -61.5108 -50.7172 -50.7122 -18.8928 -18.8796 -18.1270 -18.1094 -16.9201 -16.9095 -16.5922 -16.5802 -15.9547 -15.9544 -8.8264 -8.6676 -7.0624 -6.9635 -1.6479 -1.5931 3.5702 3.6949 5.0814 5.1723 7.0122 7.0748 9.7522 10.0159 11.0014 11.1618 13.5126 13.7477 k = 0.5497-0.0479-1.0348 ( 2992 PWs) bands (ev): ************************************-176.0376-176.0281-138.2757-138.2705 -92.7397 -92.7397 -64.3853 -64.3833 -63.5163 -63.5141 -61.5112 -61.5108 -50.7513 -50.7455 -18.9027 -18.8908 -18.1183 -18.1024 -16.9239 -16.9142 -16.5899 -16.5789 -15.9552 -15.9550 -8.8238 -8.6766 -7.0816 -6.9906 -1.6741 -1.6236 3.6620 3.7965 5.1370 5.2504 6.9840 7.0390 9.7097 9.9680 10.9899 11.1335 13.5619 13.8201 k = 0.5452-0.0312-1.0348 ( 2992 PWs) bands (ev): ************************************-176.0379-176.0287-138.2748-138.2703 -92.7398 -92.7397 -64.3850 -64.3831 -63.5160 -63.5140 -61.5112 -61.5109 -50.7513 -50.7450 -18.9134 -18.9028 -18.1062 -18.0920 -16.9267 -16.9178 -16.5858 -16.5759 -15.9550 -15.9548 -8.8169 -8.6821 -7.0989 -7.0156 -1.6978 -1.6518 3.7409 3.8805 5.2075 5.3377 6.9588 7.0063 9.6639 9.9148 10.9774 11.1048 13.5863 13.8565 k = 0.5407-0.0146-1.0348 ( 2994 PWs) bands (ev): ************************************-176.0391-176.0309-138.2773-138.2705 -92.7401 -92.7401 -64.3847 -64.3831 -63.5158 -63.5140 -61.5113 -61.5110 -50.7884 -50.7812 -18.9212 -18.9118 -18.0985 -18.0857 -16.9321 -16.9241 -16.5838 -16.5750 -15.9549 -15.9548 -8.8139 -8.6917 -7.1147 -7.0393 -1.7191 -1.6774 3.8071 3.9463 5.2914 5.4316 6.9345 6.9750 9.6153 9.8561 10.9634 11.0756 13.5855 13.8454 k = 0.5362 0.0021-1.0348 ( 2996 PWs) bands (ev): ************************************-176.0391-176.0338-138.2799-138.2716 -92.7405 -92.7405 -64.3845 -64.3830 -63.5156 -63.5140 -61.5114 -61.5111 -50.8150 -50.8052 -18.9287 -18.9205 -18.0921 -18.0809 -16.9369 -16.9298 -16.5807 -16.5729 -15.9554 -15.9552 -8.8116 -8.7034 -7.1291 -7.0617 -1.7380 -1.7005 3.8618 3.9957 5.3860 5.5295 6.9129 6.9465 9.5650 9.7929 10.9499 11.0476 13.5641 13.7944 k = 0.5317 0.0188-1.0348 ( 2994 PWs) bands (ev): ************************************-176.0375-176.0300-138.2830-138.2683 -92.7402 -92.7402 -64.3842 -64.3829 -63.5153 -63.5139 -61.5113 -61.5111 -50.7677 -50.7553 -18.9304 -18.9232 -18.0884 -18.0785 -16.9375 -16.9313 -16.5716 -16.5649 -15.9578 -15.9576 -8.8080 -8.7128 -7.1402 -7.0814 -1.7532 -1.7204 3.9079 4.0312 5.4869 5.6282 6.8957 6.9224 9.5154 9.7266 10.9380 11.0220 13.5308 13.7257 k = 0.5271 0.0355-1.0348 ( 3004 PWs) bands (ev): ************************************-176.0432-176.0364-138.2879-138.2796 -92.7419 -92.7419 -64.3842 -64.3831 -63.5154 -63.5142 -61.5117 -61.5115 -50.8887 -50.8776 -18.9356 -18.9294 -18.0919 -18.0834 -16.9435 -16.9382 -16.5793 -16.5735 -15.9635 -15.9633 -8.8189 -8.7358 -7.1518 -7.1015 -1.7676 -1.7395 3.9446 4.0541 5.5891 5.7220 6.8761 6.8960 9.4666 9.6568 10.9253 10.9962 13.4924 13.6532 k = 0.5226 0.0522-1.0348 ( 3012 PWs) bands (ev): ************************************-176.0470-176.0407-138.2930-138.2893 -92.7433 -92.7433 -64.3842 -64.3833 -63.5154 -63.5144 -61.5120 -61.5118 -50.9598 -50.9502 -18.9434 -18.9383 -18.0897 -18.0826 -16.9475 -16.9430 -16.5886 -16.5837 -15.9666 -15.9665 -8.8268 -8.7581 -7.1615 -7.1191 -1.7801 -1.7572 3.9750 4.0680 5.6884 5.8083 6.8595 6.8738 9.4218 9.5877 10.9150 10.9733 13.4554 13.5850 k = 0.5181 0.0688-1.0348 ( 3012 PWs) bands (ev): ************************************-176.0462-176.0413-138.2927-138.2895 -92.7434 -92.7434 -64.3840 -64.3833 -63.5152 -63.5144 -61.5120 -61.5119 -50.9597 -50.9513 -18.9470 -18.9429 -18.0851 -18.0794 -16.9486 -16.9450 -16.5864 -16.5825 -15.9668 -15.9667 -8.8209 -8.7655 -7.1667 -7.1327 -1.7889 -1.7705 4.0007 4.0766 5.7813 5.8841 6.8465 6.8564 9.3850 9.5239 10.9078 10.9541 13.4244 13.5252 k = 0.5136 0.0855-1.0348 ( 3012 PWs) bands (ev): ************************************-176.0455-176.0419-138.2924-138.2897 -92.7434 -92.7434 -64.3838 -64.3833 -63.5150 -63.5144 -61.5120 -61.5119 -50.9594 -50.9521 -18.9497 -18.9466 -18.0813 -18.0771 -16.9494 -16.9467 -16.5845 -16.5816 -15.9670 -15.9669 -8.8148 -8.7728 -7.1698 -7.1443 -1.7952 -1.7814 4.0220 4.0797 5.8627 5.9444 6.8357 6.8424 9.3575 9.4658 10.9032 10.9377 13.4012 13.4752 k = 0.5090 0.1022-1.0348 ( 3012 PWs) bands (ev): ************************************-176.0448-176.0426-138.2922-138.2899 -92.7435 -92.7435 -64.3837 -64.3833 -63.5149 -63.5145 -61.5120 -61.5119 -50.9591 -50.9528 -18.9514 -18.9494 -18.0783 -18.0755 -16.9498 -16.9481 -16.5830 -16.5811 -15.9671 -15.9670 -8.8084 -8.7800 -7.1708 -7.1539 -1.7991 -1.7899 4.0396 4.0784 5.9289 5.9858 6.8276 6.8320 9.3416 9.4161 10.9014 10.9243 13.3871 13.4357 k = 0.5045 0.1189-1.0348 ( 3014 PWs) bands (ev): ************************************-176.0459-176.0443-138.2945-138.2900 -92.7438 -92.7438 -64.3836 -64.3835 -63.5148 -63.5146 -61.5120 -61.5120 -50.9744 -50.9708 -18.9528 -18.9518 -18.0794 -18.0780 -16.9503 -16.9494 -16.5830 -16.5821 -15.9677 -15.9676 -8.8048 -8.7901 -7.1701 -7.1618 -1.8007 -1.7961 4.0539 4.0732 5.9762 6.0055 6.8223 6.8245 9.3391 9.3765 10.9021 10.9137 13.3831 13.4072 k = 0.5000 0.1356-1.0348 ( 3016 PWs) bands (ev): ************************************-176.0458-176.0458-138.2945-138.2945 -92.7442 -92.7442 -64.3836 -64.3836 -63.5148 -63.5148 -61.5120 -61.5120 -50.9670 -50.9670 -18.9565 -18.9565 -18.0784 -18.0784 -16.9471 -16.9471 -16.5878 -16.5878 -15.9667 -15.9667 -8.8015 -8.8015 -7.1671 -7.1671 -1.8006 -1.8006 4.0650 4.0650 6.0019 6.0019 6.8215 6.8215 9.3499 9.3499 10.9064 10.9064 13.3895 13.3895 k = 0.5000 0.1356-1.0348 ( 3016 PWs) bands (ev): ************************************-176.0458-176.0458-138.2945-138.2945 -92.7442 -92.7442 -64.3836 -64.3836 -63.5148 -63.5148 -61.5120 -61.5120 -50.9670 -50.9670 -18.9565 -18.9565 -18.0784 -18.0784 -16.9471 -16.9471 -16.5878 -16.5878 -15.9667 -15.9667 -8.8015 -8.8015 -7.1671 -7.1671 -1.8006 -1.8006 4.0650 4.0650 6.0019 6.0019 6.8215 6.8215 9.3499 9.3499 10.9064 10.9064 13.3895 13.3895 k = 0.5144 0.1395-1.0273 ( 3016 PWs) bands (ev): ************************************-176.0467-176.0454-138.2946-138.2919 -92.7442 -92.7442 -64.3836 -64.3836 -63.5148 -63.5148 -61.5120 -61.5120 -50.9882 -50.9858 -18.9555 -18.9555 -18.0787 -18.0787 -16.9502 -16.9499 -16.5845 -16.5844 -15.9679 -15.9679 -8.8010 -8.7976 -7.1724 -7.1625 -1.8021 -1.7975 4.0616 4.0656 6.0019 6.0025 6.8190 6.8275 9.3440 9.3548 10.8940 10.9188 13.3832 13.4020 k = 0.5288 0.1434-1.0199 ( 3016 PWs) bands (ev): ************************************-176.0467-176.0456-138.2943-138.2922 -92.7442 -92.7442 -64.3836 -64.3836 -63.5148 -63.5148 -61.5121 -61.5120 -50.9878 -50.9861 -18.9555 -18.9555 -18.0788 -18.0787 -16.9503 -16.9496 -16.5845 -16.5844 -15.9679 -15.9679 -8.8039 -8.7956 -7.1775 -7.1583 -1.8029 -1.7939 4.0562 4.0637 6.0022 6.0031 6.8207 6.8376 9.3360 9.3578 10.8831 10.9321 13.3830 13.4202 k = 0.5432 0.1473-1.0124 ( 3012 PWs) bands (ev): ************************************-176.0455-176.0431-138.2933-138.2896 -92.7434 -92.7434 -64.3835 -64.3834 -63.5146 -63.5146 -61.5120 -61.5119 -50.9509 -50.9491 -18.9521 -18.9521 -18.0754 -18.0753 -16.9499 -16.9487 -16.5811 -16.5810 -15.9673 -15.9672 -8.8052 -8.7892 -7.1822 -7.1535 -1.8018 -1.7885 4.0490 4.0598 6.0031 6.0044 6.8271 6.8519 9.3271 9.3605 10.8742 10.9462 13.3893 13.4442 k = 0.5576 0.1512-1.0049 ( 3010 PWs) bands (ev): ************************************-176.0448-176.0402-138.2928-138.2813 -92.7432 -92.7432 -64.3835 -64.3834 -63.5147 -63.5147 -61.5117 -61.5116 -50.9549 -50.9528 -18.9519 -18.9519 -18.0798 -18.0797 -16.9492 -16.9477 -16.5784 -16.5783 -15.9595 -15.9593 -8.8012 -8.7802 -7.1873 -7.1489 -1.8005 -1.7828 4.0394 4.0537 6.0041 6.0057 6.8368 6.8690 9.3177 9.3614 10.8661 10.9600 13.4016 13.4733 k = 0.5720 0.1551-0.9975 ( 3008 PWs) bands (ev): ************************************-176.0445-176.0394-138.2922-138.2797 -92.7428 -92.7428 -64.3835 -64.3834 -63.5146 -63.5146 -61.5116 -61.5114 -50.9167 -50.9149 -18.9517 -18.9517 -18.0794 -18.0793 -16.9476 -16.9457 -16.5753 -16.5752 -15.9586 -15.9584 -8.8037 -8.7773 -7.1929 -7.1451 -1.7982 -1.7761 4.0277 4.0456 6.0055 6.0073 6.8506 6.8896 9.3065 9.3605 10.8594 10.9737 13.4203 13.5072 k = 0.5863 0.1590-0.9900 ( 3004 PWs) bands (ev): ************************************-176.0429-176.0359-138.2883-138.2724 -92.7422 -92.7422 -64.3834 -64.3832 -63.5145 -63.5145 -61.5114 -61.5112 -50.8951 -50.8935 -18.9506 -18.9506 -18.0787 -18.0785 -16.9464 -16.9441 -16.5674 -16.5672 -15.9575 -15.9571 -8.7950 -8.7675 -7.1981 -7.1396 -1.7942 -1.7686 4.0142 4.0363 6.0078 6.0095 6.8676 6.9124 9.2959 9.3595 10.8541 10.9864 13.4452 13.5458 k = 0.6007 0.1629-0.9825 ( 3000 PWs) bands (ev): ************************************-176.0402-176.0339-138.2854-138.2707 -92.7415 -92.7415 -64.3833 -64.3831 -63.5144 -63.5144 -61.5112 -61.5110 -50.7883 -50.7862 -18.9502 -18.9502 -18.0775 -18.0773 -16.9419 -16.9392 -16.5641 -16.5638 -15.9546 -15.9541 -8.7954 -8.7627 -7.2042 -7.1357 -1.7897 -1.7602 3.9995 4.0256 6.0098 6.0116 6.8885 6.9380 9.2846 9.3580 10.8503 10.9988 13.4768 13.5884 k = 0.6151 0.1668-0.9751 ( 3000 PWs) bands (ev): ************************************-176.0417-176.0336-138.2893-138.2717 -92.7414 -92.7414 -64.3832 -64.3830 -63.5143 -63.5143 -61.5113 -61.5111 -50.7608 -50.7597 -18.9499 -18.9498 -18.0751 -18.0749 -16.9403 -16.9373 -16.5649 -16.5646 -15.9587 -15.9583 -8.8038 -8.7679 -7.2116 -7.1331 -1.7845 -1.7516 3.9827 4.0127 6.0118 6.0138 6.9104 6.9634 9.2727 9.3549 10.8470 11.0094 13.5124 13.6334 k = 0.6295 0.1707-0.9676 ( 2995 PWs) bands (ev): ************************************-176.0412-176.0287-138.2920-138.2645 -92.7405 -92.7405 -64.3829 -64.3827 -63.5139 -63.5139 -61.5114 -61.5111 -50.6687 -50.6646 -18.9466 -18.9466 -18.0697 -18.0694 -16.9369 -16.9336 -16.5594 -16.5591 -15.9629 -15.9622 -8.8029 -8.7636 -7.2179 -7.1275 -1.7776 -1.7415 3.9658 4.0008 6.0148 6.0165 6.9358 6.9907 9.2634 9.3530 10.8463 11.0202 13.5528 13.6811 k = 0.6439 0.1746-0.9601 ( 2993 PWs) bands (ev): ************************************-176.0405-176.0271-138.2906-138.2589 -92.7403 -92.7403 -64.3829 -64.3827 -63.5140 -63.5140 -61.5111 -61.5108 -50.6622 -50.6575 -18.9483 -18.9483 -18.0705 -18.0702 -16.9381 -16.9346 -16.5572 -16.5568 -15.9549 -15.9541 -8.8066 -8.7589 -7.2254 -7.1249 -1.7704 -1.7307 3.9470 3.9863 6.0177 6.0194 6.9605 7.0161 9.2562 9.3518 10.8453 11.0277 13.5957 13.7285 k = 0.6583 0.1785-0.9527 ( 2999 PWs) bands (ev): ************************************-176.0445-176.0315-138.2918-138.2667 -92.7413 -92.7413 -64.3831 -64.3829 -63.5142 -63.5142 -61.5112 -61.5109 -50.7293 -50.7247 -18.9504 -18.9503 -18.0783 -18.0779 -16.9417 -16.9379 -16.5582 -16.5579 -15.9587 -15.9578 -8.8248 -8.7692 -7.2351 -7.1255 -1.7624 -1.7198 3.9271 3.9701 6.0205 6.0220 6.9843 7.0393 9.2480 9.3500 10.8444 11.0330 13.6395 13.7747 k = 0.6583 0.1785-0.9527 ( 2999 PWs) bands (ev): ************************************-176.0445-176.0315-138.2918-138.2667 -92.7413 -92.7413 -64.3831 -64.3829 -63.5142 -63.5142 -61.5112 -61.5109 -50.7293 -50.7247 -18.9504 -18.9503 -18.0783 -18.0779 -16.9417 -16.9379 -16.5582 -16.5579 -15.9587 -15.9578 -8.8248 -8.7692 -7.2351 -7.1255 -1.7624 -1.7198 3.9271 3.9701 6.0205 6.0220 6.9843 7.0393 9.2480 9.3500 10.8444 11.0330 13.6395 13.7747 k = 0.6557 0.1778-0.9357 ( 2999 PWs) bands (ev): ************************************-176.0448-176.0315-138.2920-138.2664 -92.7413 -92.7413 -64.3830 -64.3826 -63.5139 -63.5139 -61.5113 -61.5108 -50.7288 -50.7241 -18.9490 -18.9489 -18.0811 -18.0807 -16.9404 -16.9356 -16.5579 -16.5574 -15.9621 -15.9601 -8.8412 -8.7612 -7.2811 -7.1338 -1.7210 -1.6672 3.8708 3.9166 6.0320 6.0335 7.0431 7.0946 9.2892 9.3903 10.8068 11.0039 13.6332 13.7725 k = 0.6531 0.1771-0.9188 ( 2995 PWs) bands (ev): ************************************-176.0444-176.0290-138.2888-138.2637 -92.7407 -92.7407 -64.3825 -64.3821 -63.5134 -63.5134 -61.5114 -61.5108 -50.6920 -50.6872 -18.9457 -18.9456 -18.0781 -18.0776 -16.9382 -16.9324 -16.5573 -16.5567 -15.9630 -15.9600 -8.8540 -8.7464 -7.3332 -7.1474 -1.6678 -1.6032 3.8084 3.8575 6.0461 6.0484 7.1085 7.1579 9.3292 9.4302 10.7724 10.9766 13.6284 13.7727 k = 0.6505 0.1764-0.9018 ( 2995 PWs) bands (ev): ************************************-176.0435-176.0284-138.2880-138.2636 -92.7408 -92.7408 -64.3822 -64.3817 -63.5129 -63.5129 -61.5115 -61.5109 -50.7016 -50.6972 -18.9437 -18.9436 -18.0811 -18.0804 -16.9368 -16.9300 -16.5569 -16.5562 -15.9682 -15.9641 -8.8709 -8.7365 -7.3920 -7.1689 -1.6036 -1.5288 3.7399 3.7919 6.0630 6.0661 7.1778 7.2267 9.3662 9.4675 10.7402 10.9498 13.6239 13.7737 k = 0.6479 0.1757-0.8848 ( 2990 PWs) bands (ev): ************************************-176.0423-176.0268-138.2814-138.2625 -92.7400 -92.7400 -64.3816 -64.3810 -63.5122 -63.5122 -61.5116 -61.5109 -50.6569 -50.6540 -18.9386 -18.9385 -18.0767 -18.0759 -16.9368 -16.9290 -16.5579 -16.5572 -15.9676 -15.9626 -8.8871 -8.7197 -7.4561 -7.1936 -1.5284 -1.4443 3.6687 3.7228 6.0827 6.0865 7.2515 7.3018 9.4012 9.5045 10.7126 10.9255 13.6187 13.7756 k = 0.6453 0.1750-0.8679 ( 2994 PWs) bands (ev): ************************************-176.0446-176.0293-138.2848-138.2676 -92.7408 -92.7408 -64.3813 -64.3806 -63.5118 -63.5117 -61.5119 -61.5111 -50.6802 -50.6770 -18.9388 -18.9387 -18.0825 -18.0817 -16.9359 -16.9271 -16.5585 -16.5576 -15.9799 -15.9737 -8.9188 -8.7251 -7.5256 -7.2250 -1.4450 -1.3523 3.5926 3.6500 6.1052 6.1096 7.3263 7.3803 9.4320 9.5360 10.6852 10.9002 13.6152 13.7779 k = 0.6427 0.1743-0.8509 ( 2994 PWs) bands (ev): ************************************-176.0450-176.0289-138.2849-138.2673 -92.7409 -92.7409 -64.3808 -64.3801 -63.5112 -63.5111 -61.5120 -61.5111 -50.6797 -50.6771 -18.9356 -18.9355 -18.0890 -18.0881 -16.9325 -16.9227 -16.5576 -16.5567 -15.9873 -15.9800 -8.9442 -8.7205 -7.5981 -7.2588 -1.3523 -1.2517 3.5144 3.5753 6.1305 6.1357 7.4022 7.4628 9.4628 9.5668 10.6616 10.8770 13.6133 13.7835 k = 0.6401 0.1736-0.8339 ( 2992 PWs) bands (ev): ************************************-176.0436-176.0281-138.2821-138.2661 -92.7408 -92.7407 -64.3802 -64.3794 -63.5104 -63.5104 -61.5121 -61.5111 -50.6447 -50.6411 -18.9298 -18.9297 -18.0961 -18.0950 -16.9263 -16.9155 -16.5567 -16.5557 -15.9943 -15.9858 -8.9694 -8.7110 -7.6728 -7.2941 -1.2518 -1.1436 3.4353 3.4996 6.1587 6.1646 7.4783 7.5482 9.4928 9.5964 10.6406 10.8552 13.6147 13.7915 k = 0.6375 0.1729-0.8170 ( 2996 PWs) bands (ev): ************************************-176.0438-176.0306-138.2800-138.2715 -92.7417 -92.7417 -64.3798 -64.3789 -63.5099 -63.5099 -61.5122 -61.5111 -50.7637 -50.7582 -18.9314 -18.9312 -18.1061 -18.1050 -16.9245 -16.9127 -16.5556 -16.5545 -16.0040 -15.9943 -9.0018 -8.7121 -7.7504 -7.3347 -1.1451 -1.0301 3.3536 3.4207 6.1895 6.1961 7.5508 7.6333 9.5211 9.6230 10.6213 10.8340 13.6132 13.7978 k = 0.6349 0.1722-0.8000 ( 3000 PWs) bands (ev): ************************************-176.0443-176.0341-138.2818-138.2758 -92.7426 -92.7426 -64.3793 -64.3784 -63.5094 -63.5093 -61.5124 -61.5111 -50.7916 -50.7841 -18.9282 -18.9281 -18.1215 -18.1204 -16.9201 -16.9073 -16.5547 -16.5535 -16.0167 -16.0058 -9.0414 -8.7166 -7.8295 -7.3777 -1.0325 -0.9117 3.2729 3.3429 6.2228 6.2299 7.6217 7.7195 9.5497 9.6484 10.6034 10.8140 13.6170 13.8065 k = 0.6323 0.1715-0.7830 ( 2998 PWs) bands (ev): ************************************-176.0441-176.0345-138.2806-138.2769 -92.7425 -92.7424 -64.3786 -64.3775 -63.5084 -63.5084 -61.5126 -61.5112 -50.7511 -50.7441 -18.9215 -18.9213 -18.1282 -18.1270 -16.9170 -16.9031 -16.5535 -16.5521 -16.0244 -16.0122 -9.0786 -8.7198 -7.9070 -7.4187 -0.9147 -0.7882 3.1942 3.2679 6.2591 6.2669 7.6904 7.8073 9.5797 9.6729 10.5875 10.7955 13.6241 13.8199 k = 0.6297 0.1707-0.7661 ( 3000 PWs) bands (ev): ************************************-176.0447-176.0353-138.2815-138.2783 -92.7430 -92.7430 -64.3779 -64.3768 -63.5075 -63.5075 -61.5128 -61.5114 -50.7890 -50.7791 -18.9169 -18.9167 -18.1383 -18.1370 -16.9133 -16.8983 -16.5552 -16.5537 -16.0366 -16.0232 -9.1177 -8.7278 -7.9834 -7.4592 -0.7935 -0.6620 3.1169 3.1940 6.2976 6.3064 7.7534 7.8931 9.6099 9.6974 10.5725 10.7776 13.6327 13.8348 k = 0.6272 0.1700-0.7491 ( 2998 PWs) bands (ev): ************************************-176.0406-176.0329-138.2782-138.2757 -92.7430 -92.7430 -64.3771 -64.3759 -63.5066 -63.5065 -61.5128 -61.5113 -50.7973 -50.7857 -18.9130 -18.9128 -18.1480 -18.1466 -16.9017 -16.8853 -16.5530 -16.5514 -16.0490 -16.0341 -9.1532 -8.7306 -8.0536 -7.4936 -0.6698 -0.5329 3.0429 3.1236 6.3390 6.3486 7.8117 7.9774 9.6406 9.7244 10.5602 10.7620 13.6453 13.8538 k = 0.6246 0.1693-0.7322 ( 2998 PWs) bands (ev): ************************************-176.0412-176.0326-138.2783-138.2750 -92.7432 -92.7432 -64.3762 -64.3750 -63.5055 -63.5055 -61.5130 -61.5115 -50.7993 -50.7900 -18.9055 -18.9052 -18.1606 -18.1592 -16.8952 -16.8774 -16.5547 -16.5529 -16.0598 -16.0436 -9.1944 -8.7461 -8.1213 -7.5301 -0.5448 -0.4038 2.9732 3.0574 6.3824 6.3929 7.8630 8.0584 9.6699 9.7542 10.5493 10.7478 13.6626 13.8763 k = 0.6220 0.1686-0.7152 ( 2999 PWs) bands (ev): ************************************-176.0398-176.0343-138.2779-138.2738 -92.7437 -92.7437 -64.3753 -64.3740 -63.5044 -63.5044 -61.5134 -61.5118 -50.8895 -50.8812 -18.8958 -18.8955 -18.1730 -18.1716 -16.8917 -16.8727 -16.5563 -16.5543 -16.0744 -16.0567 -9.2386 -8.7663 -8.1789 -7.5630 -0.4196 -0.2747 2.9075 2.9946 6.4286 6.4397 7.9069 8.1343 9.6956 9.7907 10.5408 10.7356 13.6802 13.8972 k = 0.6194 0.1679-0.6982 ( 2991 PWs) bands (ev): ************************************-176.0349-176.0288-138.2723-138.2673 -92.7427 -92.7427 -64.3741 -64.3728 -63.5030 -63.5029 -61.5134 -61.5117 -50.7821 -50.7718 -18.8885 -18.8882 -18.1759 -18.1743 -16.8794 -16.8589 -16.5521 -16.5499 -16.0847 -16.0655 -9.2806 -8.7925 -8.2206 -7.5879 -0.2958 -0.1464 2.8513 2.9415 6.4776 6.4896 7.9460 8.2077 9.7173 9.8353 10.5361 10.7262 13.7055 13.9260 k = 0.6168 0.1672-0.6813 ( 2988 PWs) bands (ev): ************************************-176.0337-176.0272-138.2707-138.2664 -92.7425 -92.7425 -64.3731 -64.3717 -63.5017 -63.5017 -61.5135 -61.5117 -50.7162 -50.7062 -18.8811 -18.8808 -18.1864 -18.1848 -16.8709 -16.8489 -16.5484 -16.5460 -16.0978 -16.0770 -9.3328 -8.8393 -8.2564 -7.6173 -0.1752 -0.0225 2.8024 2.8953 6.5285 6.5415 7.9775 8.2746 9.7328 9.8854 10.5342 10.7188 13.7330 13.9559 k = 0.6142 0.1665-0.6643 ( 2987 PWs) bands (ev): ************************************-176.0336-176.0251-138.2698-138.2659 -92.7426 -92.7426 -64.3721 -64.3707 -63.5005 -63.5004 -61.5137 -61.5118 -50.6999 -50.6931 -18.8743 -18.8740 -18.1977 -18.1961 -16.8647 -16.8412 -16.5460 -16.5433 -16.1121 -16.0898 -9.3880 -8.8973 -8.2823 -7.6434 -0.0593 0.0957 2.7620 2.8568 6.5816 6.5955 8.0013 8.3341 9.7423 9.9401 10.5365 10.7153 13.7646 13.9884 k = 0.6116 0.1658-0.6473 ( 2985 PWs) bands (ev): ************************************-176.0324-176.0231-138.2677-138.2647 -92.7427 -92.7427 -64.3710 -64.3695 -63.4992 -63.4991 -61.5138 -61.5119 -50.6692 -50.6633 -18.8680 -18.8676 -18.2082 -18.2065 -16.8561 -16.8309 -16.5433 -16.5402 -16.1271 -16.1032 -9.4435 -8.9623 -8.2971 -7.6665 0.0497 0.2063 2.7340 2.8302 6.6369 6.6518 8.0186 8.3872 9.7471 9.9970 10.5440 10.7175 13.8000 14.0245 k = 0.6090 0.1651-0.6304 ( 2983 PWs) bands (ev): ************************************-176.0305-176.0212-138.2664-138.2629 -92.7427 -92.7427 -64.3699 -64.3684 -63.4979 -63.4978 -61.5139 -61.5119 -50.5966 -50.5945 -18.8613 -18.8610 -18.2211 -18.2194 -16.8459 -16.8190 -16.5414 -16.5380 -16.1402 -16.1146 -9.5015 -9.0333 -8.3055 -7.6872 0.1498 0.3069 2.7204 2.8171 6.6944 6.7101 8.0300 8.4330 9.7468 10.0527 10.5581 10.7293 13.8413 14.0647 k = 0.6064 0.1644-0.6134 ( 2981 PWs) bands (ev): ************************************-176.0313-176.0193-138.2652-138.2605 -92.7427 -92.7427 -64.3687 -64.3672 -63.4965 -63.4964 -61.5141 -61.5120 -50.5871 -50.5841 -18.8540 -18.8537 -18.2310 -18.2293 -16.8395 -16.8109 -16.5402 -16.5363 -16.1541 -16.1269 -9.5613 -9.1092 -8.3065 -7.7046 0.2389 0.3954 2.7219 2.8178 6.7536 6.7704 8.0357 8.4718 9.7404 10.1034 10.5797 10.7512 13.8834 14.1066 k = 0.6038 0.1637-0.5964 ( 2983 PWs) bands (ev): ************************************-176.0321-176.0187-138.2651-138.2614 -92.7435 -92.7435 -64.3677 -64.3662 -63.4952 -63.4952 -61.5143 -61.5122 -50.6320 -50.6267 -18.8496 -18.8492 -18.2466 -18.2449 -16.8317 -16.8010 -16.5386 -16.5343 -16.1725 -16.1434 -9.6226 -9.1888 -8.3092 -7.7237 0.3148 0.4687 2.7402 2.8341 6.8147 6.8326 8.0354 8.5024 9.7280 10.1441 10.6107 10.7849 13.9284 14.1505 k = 0.6012 0.1630-0.5795 ( 2987 PWs) bands (ev): ************************************-176.0329-176.0243-138.2709-138.2642 -92.7445 -92.7445 -64.3667 -64.3651 -63.4939 -63.4939 -61.5147 -61.5126 -50.6823 -50.6762 -18.8449 -18.8445 -18.2605 -18.2588 -16.8306 -16.7984 -16.5397 -16.5349 -16.1895 -16.1589 -9.6895 -9.2715 -8.3148 -7.7494 0.3760 0.5256 2.7778 2.8671 6.8774 6.8961 8.0311 8.5244 9.7086 10.1701 10.6544 10.8308 13.9764 14.1946 k = 0.5986 0.1623-0.5625 ( 2991 PWs) bands (ev): ************************************-176.0353-176.0259-138.2735-138.2685 -92.7456 -92.7456 -64.3657 -64.3640 -63.4927 -63.4927 -61.5149 -61.5128 -50.7123 -50.7057 -18.8425 -18.8421 -18.2766 -18.2749 -16.8257 -16.7914 -16.5385 -16.5330 -16.2084 -16.1760 -9.7550 -9.3548 -8.3218 -7.7725 0.4223 0.5663 2.8348 2.9196 6.9418 6.9618 8.0232 8.5404 9.6848 10.1807 10.7125 10.8884 14.0282 14.2434 k = 0.5960 0.1616-0.5456 ( 2989 PWs) bands (ev): ************************************-176.0344-176.0253-138.2725-138.2660 -92.7457 -92.7457 -64.3645 -64.3628 -63.4913 -63.4912 -61.5150 -61.5128 -50.6763 -50.6654 -18.8359 -18.8354 -18.2911 -18.2894 -16.8171 -16.7807 -16.5330 -16.5268 -16.2238 -16.1894 -9.8188 -9.4369 -8.3134 -7.7822 0.4546 0.5922 2.9133 2.9924 7.0081 7.0294 8.0137 8.5527 9.6581 10.1784 10.7847 10.9566 14.0835 14.2950 k = 0.5934 0.1609-0.5286 ( 2987 PWs) bands (ev): ************************************-176.0310-176.0236-138.2718-138.2615 -92.7457 -92.7457 -64.3632 -64.3616 -63.4898 -63.4897 -61.5151 -61.5129 -50.6497 -50.6381 -18.8282 -18.8277 -18.3047 -18.3030 -16.8063 -16.7671 -16.5311 -16.5239 -16.2407 -16.2042 -9.8806 -9.5172 -8.2976 -7.7883 0.4725 0.6034 3.0087 3.0814 7.0758 7.0984 8.0026 8.5595 9.6282 10.1644 10.8671 11.0330 14.1416 14.3501 k = 0.5908 0.1602-0.5116 ( 2987 PWs) bands (ev): ************************************-176.0308-176.0229-138.2716-138.2617 -92.7461 -92.7461 -64.3620 -64.3604 -63.4884 -63.4883 -61.5153 -61.5130 -50.6514 -50.6402 -18.8214 -18.8208 -18.3189 -18.3172 -16.7989 -16.7571 -16.5299 -16.5216 -16.2579 -16.2193 -9.9449 -9.5985 -8.2887 -7.7973 0.4772 0.6008 3.1193 3.1857 7.1447 7.1688 7.9893 8.5609 9.5953 10.1418 10.9566 11.1157 14.1996 14.4042 k = 0.5882 0.1595-0.4947 ( 2986 PWs) bands (ev): ************************************-176.0303-176.0203-138.2704-138.2632 -92.7463 -92.7463 -64.3608 -64.3592 -63.4869 -63.4868 -61.5154 -61.5131 -50.6331 -50.6209 -18.8133 -18.8127 -18.3354 -18.3337 -16.7893 -16.7444 -16.5265 -16.5169 -16.2757 -16.2347 -10.0085 -9.6788 -8.2786 -7.8060 0.4708 0.5869 3.2441 3.3047 7.2148 7.2405 7.9751 8.5582 9.5606 10.1138 11.0514 11.2034 14.2591 14.4590 k = 0.5856 0.1588-0.4777 ( 2992 PWs) bands (ev): ************************************-176.0354-176.0261-138.2792-138.2699 -92.7477 -92.7476 -64.3597 -64.3580 -63.4855 -63.4854 -61.5160 -61.5138 -50.6970 -50.6839 -18.8066 -18.8060 -18.3507 -18.3490 -16.7861 -16.7375 -16.5297 -16.5183 -16.3027 -16.2593 -10.0759 -9.7601 -8.2848 -7.8286 0.4530 0.5622 3.3789 3.4342 7.2854 7.3130 7.9585 8.5487 9.5229 10.0776 11.1490 11.2942 14.3182 14.5125 k = 0.5830 0.1581-0.4607 ( 2993 PWs) bands (ev): ************************************-176.0363-176.0266-138.2795-138.2706 -92.7482 -92.7482 -64.3585 -64.3568 -63.4840 -63.4839 -61.5163 -61.5140 -50.7342 -50.7233 -18.7997 -18.7992 -18.3649 -18.3633 -16.7803 -16.7283 -16.5292 -16.5160 -16.3212 -16.2756 -10.1387 -9.8379 -8.2748 -7.8346 0.4282 0.5312 3.5237 3.5745 7.3570 7.3868 7.9428 8.5389 9.4857 10.0407 11.2492 11.3877 14.3762 14.5656 k = 0.5804 0.1574-0.4438 ( 2997 PWs) bands (ev): ************************************-176.0385-176.0303-138.2850-138.2735 -92.7492 -92.7492 -64.3574 -64.3558 -63.4827 -63.4826 -61.5165 -61.5143 -50.7390 -50.7281 -18.7969 -18.7963 -18.3816 -18.3799 -16.7766 -16.7211 -16.5289 -16.5137 -16.3386 -16.2911 -10.2022 -9.9145 -8.2755 -7.8527 0.3968 0.4937 3.6761 3.7232 7.4287 7.4611 7.9281 8.5268 9.4478 10.0003 11.3499 11.4819 14.4333 14.6169 k = 0.5778 0.1567-0.4268 ( 2999 PWs) bands (ev): ************************************-176.0398-176.0318-138.2855-138.2772 -92.7499 -92.7499 -64.3563 -64.3546 -63.4813 -63.4812 -61.5168 -61.5145 -50.7541 -50.7438 -18.7914 -18.7908 -18.3963 -18.3947 -16.7728 -16.7141 -16.5292 -16.5117 -16.3546 -16.3055 -10.2630 -9.9893 -8.2691 -7.8615 0.3600 0.4518 3.8349 3.8791 7.5007 7.5365 7.9147 8.5128 9.4099 9.9589 11.4509 11.5770 14.4894 14.6666 k = 0.5753 0.1560-0.4098 ( 3007 PWs) bands (ev): ************************************-176.0463-176.0373-138.2883-138.2829 -92.7517 -92.7516 -64.3553 -64.3537 -63.4802 -63.4800 -61.5172 -61.5149 -50.8667 -50.8565 -18.7868 -18.7862 -18.4178 -18.4162 -16.7722 -16.7103 -16.5351 -16.5153 -16.3716 -16.3211 -10.3238 -10.0631 -8.2666 -7.8748 0.3179 0.4056 3.9966 4.0386 7.5711 7.6112 7.9013 8.4952 9.3704 9.9139 11.5510 11.6713 14.5422 14.7126 k = 0.5727 0.1553-0.3929 ( 3003 PWs) bands (ev): ************************************-176.0442-176.0335-138.2855-138.2818 -92.7513 -92.7513 -64.3540 -64.3523 -63.4785 -63.4784 -61.5172 -61.5150 -50.8087 -50.8013 -18.7786 -18.7780 -18.4277 -18.4262 -16.7655 -16.6994 -16.5319 -16.5083 -16.3853 -16.3335 -10.3810 -10.1330 -8.2500 -7.8730 0.2766 0.3600 4.1650 4.2052 7.6409 7.6878 7.8946 8.4819 9.3349 9.8723 11.6499 11.7646 14.5939 14.7574 k = 0.5701 0.1546-0.3759 ( 3008 PWs) bands (ev): ************************************-176.0479-176.0344-138.2861-138.2837 -92.7526 -92.7526 -64.3530 -64.3514 -63.4774 -63.4772 -61.5174 -61.5152 -50.8632 -50.8574 -18.7795 -18.7789 -18.4452 -18.4437 -16.7619 -16.6919 -16.5329 -16.5054 -16.3988 -16.3462 -10.4388 -10.2032 -8.2404 -7.8749 0.2305 0.3105 4.3326 4.3712 7.7048 7.7632 7.8927 8.4653 9.2985 9.8276 11.7446 11.8540 14.6411 14.7976 k = 0.5675 0.1539-0.3590 ( 3008 PWs) bands (ev): ************************************-176.0473-176.0323-138.2866-138.2830 -92.7529 -92.7529 -64.3518 -64.3503 -63.4759 -63.4758 -61.5175 -61.5154 -50.8800 -50.8772 -18.7730 -18.7724 -18.4584 -18.4569 -16.7573 -16.6829 -16.5348 -16.5023 -16.4114 -16.3584 -10.4935 -10.2703 -8.2282 -7.8738 0.1845 0.2611 4.5029 4.5401 7.7578 7.8385 7.9052 8.4505 9.2634 9.7843 11.8371 11.9414 14.6865 14.8352 k = 0.5649 0.1532-0.3420 ( 3010 PWs) bands (ev): ************************************-176.0491-176.0330-138.2888-138.2846 -92.7536 -92.7536 -64.3508 -64.3492 -63.4746 -63.4745 -61.5177 -61.5156 -50.9000 -50.8971 -18.7676 -18.7670 -18.4738 -18.4724 -16.7541 -16.6753 -16.5385 -16.5004 -16.4229 -16.3701 -10.5479 -10.3357 -8.2203 -7.8779 0.1372 0.2110 4.6740 4.7100 7.7901 7.9112 7.9415 8.4367 9.2294 9.7400 11.9242 12.0236 14.7284 14.8691 k = 0.5623 0.1525-0.3250 ( 3006 PWs) bands (ev): ************************************-176.0429-176.0309-138.2838-138.2818 -92.7532 -92.7532 -64.3496 -64.3480 -63.4731 -63.4730 -61.5177 -61.5156 -50.8355 -50.8322 -18.7604 -18.7598 -18.4858 -18.4845 -16.7448 -16.6604 -16.5412 -16.4969 -16.4300 -16.3766 -10.5982 -10.3970 -8.1941 -7.8700 0.0916 0.1623 4.8461 4.8806 7.8067 7.9783 8.0031 8.4284 9.1985 9.6980 12.0059 12.1008 14.7680 14.9006 k = 0.5597 0.1518-0.3081 ( 3006 PWs) bands (ev): ************************************-176.0434-176.0309-138.2838-138.2832 -92.7536 -92.7536 -64.3485 -64.3470 -63.4718 -63.4717 -61.5177 -61.5157 -50.7994 -50.7955 -18.7569 -18.7564 -18.4993 -18.4981 -16.7407 -16.6521 -16.5437 -16.4926 -16.4366 -16.3845 -10.6485 -10.4579 -8.1836 -7.8716 0.0457 0.1139 5.0168 5.0500 7.8151 8.0413 8.0748 8.4220 9.1685 9.6562 12.0795 12.1698 14.8056 14.9300 k = 0.5571 0.1510-0.2911 ( 3002 PWs) bands (ev): ************************************-176.0407-176.0264-138.2829-138.2796 -92.7532 -92.7532 -64.3473 -64.3458 -63.4704 -63.4703 -61.5177 -61.5157 -50.7324 -50.7246 -18.7527 -18.7521 -18.5055 -18.5042 -16.7372 -16.6455 -16.5447 -16.4862 -16.4402 -16.3907 -10.6948 -10.5149 -8.1642 -7.8672 0.0011 0.0664 5.1860 5.2178 7.8240 8.1033 8.1491 8.4229 9.1404 9.6162 12.1447 12.2306 14.8424 14.9586 k = 0.5545 0.1503-0.2741 ( 3000 PWs) bands (ev): ************************************-176.0375-176.0252-138.2801-138.2780 -92.7532 -92.7532 -64.3462 -64.3448 -63.4690 -63.4689 -61.5178 -61.5159 -50.7289 -50.7204 -18.7462 -18.7456 -18.5163 -18.5151 -16.7346 -16.6413 -16.5464 -16.4834 -16.4436 -16.3957 -10.7394 -10.5698 -8.1452 -7.8607 -0.0435 0.0192 5.3508 5.3812 7.8347 8.1595 8.2226 8.4316 9.1132 9.5763 12.2000 12.2818 14.8791 14.9874 k = 0.5519 0.1496-0.2572 ( 2995 PWs) bands (ev): ************************************-176.0339-176.0228-138.2767-138.2739 -92.7526 -92.7526 -64.3450 -64.3436 -63.4676 -63.4674 -61.5178 -61.5159 -50.6285 -50.6236 -18.7378 -18.7373 -18.5253 -18.5242 -16.7321 -16.6395 -16.5440 -16.4770 -16.4432 -16.3985 -10.7828 -10.6226 -8.1214 -7.8524 -0.0849 -0.0249 5.5122 5.5414 7.8513 8.2083 8.2953 8.4535 9.0893 9.5390 12.2447 12.3225 14.9181 15.0188 k = 0.5493 0.1489-0.2402 ( 2999 PWs) bands (ev): ************************************-176.0369-176.0254-138.2828-138.2762 -92.7536 -92.7536 -64.3441 -64.3428 -63.4665 -63.4664 -61.5179 -61.5161 -50.6354 -50.6310 -18.7361 -18.7355 -18.5393 -18.5382 -16.7347 -16.6443 -16.5449 -16.4752 -16.4466 -16.4052 -10.8262 -10.6751 -8.1206 -7.8628 -0.1277 -0.0705 5.6667 5.6950 7.8701 8.2456 8.3659 8.4846 9.0652 9.5007 12.2762 12.3503 14.9590 15.0523 k = 0.5467 0.1482-0.2232 ( 3001 PWs) bands (ev): ************************************-176.0379-176.0262-138.2848-138.2763 -92.7542 -92.7542 -64.3432 -64.3420 -63.4654 -63.4653 -61.5181 -61.5164 -50.6795 -50.6746 -18.7325 -18.7320 -18.5503 -18.5493 -16.7369 -16.6500 -16.5447 -16.4752 -16.4494 -16.4102 -10.8663 -10.7239 -8.1085 -7.8650 -0.1697 -0.1150 5.8141 5.8422 7.8956 8.2752 8.4353 8.5285 9.0423 9.4634 12.2945 12.3652 15.0063 15.0925 k = 0.5441 0.1475-0.2063 ( 2999 PWs) bands (ev): ************************************-176.0353-176.0233-138.2842-138.2741 -92.7541 -92.7541 -64.3423 -64.3411 -63.4642 -63.4641 -61.5181 -61.5164 -50.6419 -50.6349 -18.7284 -18.7279 -18.5595 -18.5586 -16.7373 -16.6564 -16.5376 -16.4723 -16.4472 -16.4099 -10.9038 -10.7708 -8.0894 -7.8610 -0.2082 -0.1562 5.9551 5.9842 7.9295 8.3018 8.5033 8.5811 9.0230 9.4300 12.2994 12.3670 15.0562 15.1365 k = 0.5415 0.1468-0.1893 ( 2993 PWs) bands (ev): ************************************-176.0306-176.0182-138.2790-138.2672 -92.7533 -92.7533 -64.3411 -64.3400 -63.4629 -63.4628 -61.5181 -61.5165 -50.6130 -50.6048 -18.7209 -18.7205 -18.5624 -18.5615 -16.7374 -16.6627 -16.5300 -16.4704 -16.4439 -16.4083 -10.9367 -10.8133 -8.0600 -7.8429 -0.2443 -0.1951 6.0863 6.1181 7.9723 8.3306 8.5693 8.6389 9.0066 9.4001 12.2904 12.3552 15.1120 15.1857 k = 0.5389 0.1461-0.1723 ( 2999 PWs) bands (ev): ************************************-176.0352-176.0238-138.2840-138.2740 -92.7546 -92.7546 -64.3405 -64.3394 -63.4621 -63.4620 -61.5183 -61.5168 -50.6453 -50.6356 -18.7226 -18.7222 -18.5752 -18.5744 -16.7429 -16.6734 -16.5285 -16.4705 -16.4453 -16.4131 -10.9722 -10.8571 -8.0654 -7.8630 -0.2809 -0.2344 6.2047 6.2405 8.0212 8.3580 8.6314 8.6956 8.9903 9.3691 12.2670 12.3295 15.1756 15.2444 k = 0.5363 0.1454-0.1554 ( 2999 PWs) bands (ev): ************************************-176.0362-176.0240-138.2868-138.2730 -92.7548 -92.7548 -64.3397 -64.3386 -63.4611 -63.4610 -61.5184 -61.5170 -50.6521 -50.6434 -18.7200 -18.7196 -18.5816 -18.5809 -16.7460 -16.6822 -16.5244 -16.4700 -16.4444 -16.4147 -11.0032 -10.8966 -8.0563 -7.8669 -0.3146 -0.2709 6.3126 6.3538 8.0802 8.3936 8.6917 8.7535 8.9777 9.3432 12.2312 12.2914 15.2448 15.3098 k = 0.5337 0.1447-0.1384 ( 3001 PWs) bands (ev): ************************************-176.0368-176.0267-138.2869-138.2743 -92.7554 -92.7554 -64.3389 -64.3380 -63.4602 -63.4601 -61.5186 -61.5172 -50.7154 -50.7037 -18.7182 -18.7178 -18.5890 -18.5884 -16.7498 -16.6912 -16.5223 -16.4720 -16.4450 -16.4176 -11.0318 -10.9336 -8.0434 -7.8705 -0.3473 -0.3065 6.4066 6.4535 8.1481 8.4359 8.7477 8.8090 8.9677 9.3197 12.1833 12.2416 15.3173 15.3806 k = 0.5311 0.1440-0.1215 ( 3005 PWs) bands (ev): ************************************-176.0380-176.0274-138.2893-138.2752 -92.7563 -92.7563 -64.3384 -64.3375 -63.4596 -63.4595 -61.5186 -61.5174 -50.7617 -50.7506 -18.7223 -18.7220 -18.5972 -18.5967 -16.7546 -16.7021 -16.5176 -16.4726 -16.4430 -16.4180 -11.0587 -10.9685 -8.0349 -7.8765 -0.3783 -0.3402 6.4887 6.5415 8.2229 8.4845 8.7987 8.8613 8.9635 9.3014 12.1248 12.1812 15.3951 15.4592 k = 0.5285 0.1433-0.1045 ( 3003 PWs) bands (ev): ************************************-176.0371-176.0263-138.2891-138.2734 -92.7562 -92.7562 -64.3377 -64.3368 -63.4587 -63.4586 -61.5186 -61.5175 -50.7171 -50.7069 -18.7214 -18.7211 -18.6001 -18.5997 -16.7574 -16.7105 -16.5110 -16.4707 -16.4387 -16.4162 -11.0826 -11.0004 -8.0213 -7.8773 -0.4041 -0.3690 6.5628 6.6207 8.3045 8.5395 8.8431 8.9087 8.9712 9.2911 12.0576 12.1123 15.4737 15.5279 k = 0.5259 0.1426-0.0875 ( 3003 PWs) bands (ev): ************************************-176.0357-176.0247-138.2884-138.2713 -92.7564 -92.7564 -64.3371 -64.3363 -63.4580 -63.4580 -61.5185 -61.5175 -50.7151 -50.7054 -18.7239 -18.7236 -18.6049 -18.6045 -16.7593 -16.7177 -16.5049 -16.4693 -16.4343 -16.4140 -11.1046 -11.0302 -8.0056 -7.8756 -0.4280 -0.3958 6.6248 6.6869 8.3889 8.5975 8.8761 8.9479 8.9950 9.2874 11.9830 12.0361 15.5551 15.6107 k = 0.5234 0.1419-0.0706 ( 3007 PWs) bands (ev): ************************************-176.0387-176.0264-138.2902-138.2741 -92.7573 -92.7573 -64.3367 -64.3360 -63.4576 -63.4575 -61.5186 -61.5177 -50.7744 -50.7602 -18.7269 -18.7266 -18.6125 -18.6121 -16.7634 -16.7267 -16.5020 -16.4713 -16.4330 -16.4147 -11.1249 -11.0582 -8.0010 -7.8817 -0.4518 -0.4226 6.6757 6.7393 8.4730 8.6548 8.8967 8.9807 9.0316 9.2910 11.9027 11.9543 15.6420 15.7194 k = 0.5208 0.1412-0.0536 ( 3007 PWs) bands (ev): ************************************-176.0394-176.0254-138.2912-138.2733 -92.7574 -92.7574 -64.3362 -64.3356 -63.4569 -63.4569 -61.5187 -61.5178 -50.7694 -50.7585 -18.7277 -18.7274 -18.6150 -18.6146 -16.7659 -16.7340 -16.4980 -16.4715 -16.4303 -16.4140 -11.1419 -11.0827 -7.9897 -7.8870 -0.4715 -0.4454 6.7202 6.7834 8.5539 8.7093 8.9137 9.0130 9.0771 9.3050 11.8194 11.8691 15.7210 15.7803 k = 0.5182 0.1405-0.0366 ( 3009 PWs) bands (ev): ************************************-176.0367-176.0269-138.2882-138.2767 -92.7579 -92.7579 -64.3359 -64.3353 -63.4565 -63.4565 -61.5186 -61.5178 -50.8146 -50.8041 -18.7315 -18.7312 -18.6197 -18.6193 -16.7674 -16.7401 -16.4951 -16.4743 -16.4269 -16.4118 -11.1566 -11.1049 -7.9774 -7.8918 -0.4899 -0.4671 6.7555 6.8161 8.6264 8.7540 8.9339 9.0422 9.1273 9.3275 11.7351 11.7825 15.7967 15.8721 k = 0.5156 0.1398-0.0197 ( 3009 PWs) bands (ev): ************************************-176.0364-176.0269-138.2884-138.2763 -92.7581 -92.7581 -64.3354 -64.3350 -63.4561 -63.4560 -61.5186 -61.5179 -50.8154 -50.8056 -18.7326 -18.7323 -18.6211 -18.6209 -16.7692 -16.7461 -16.4922 -16.4748 -16.4244 -16.4114 -11.1687 -11.1247 -7.9678 -7.8954 -0.5047 -0.4851 6.7866 6.8423 8.6861 8.7846 8.9626 9.0681 9.1840 9.3587 11.6523 11.6970 15.8714 15.9541 k = 0.5130 0.1391-0.0027 ( 3009 PWs) bands (ev): ************************************-176.0374-176.0260-138.2912-138.2722 -92.7582 -92.7582 -64.3351 -64.3347 -63.4557 -63.4556 -61.5186 -61.5180 -50.8020 -50.7928 -18.7343 -18.7341 -18.6229 -18.6227 -16.7710 -16.7522 -16.4886 -16.4748 -16.4205 -16.4095 -11.1778 -11.1412 -7.9585 -7.8982 -0.5174 -0.5011 6.8140 6.8624 8.7309 8.8032 8.9970 9.0901 9.2456 9.3943 11.5743 11.6152 15.9315 15.9856 k = 0.5104 0.1384 0.0143 ( 3009 PWs) bands (ev): ************************************-176.0363-176.0265-138.2894-138.2767 -92.7582 -92.7582 -64.3348 -64.3344 -63.4553 -63.4552 -61.5187 -61.5182 -50.7879 -50.7783 -18.7338 -18.7336 -18.6225 -18.6223 -16.7747 -16.7600 -16.4872 -16.4770 -16.4174 -16.4084 -11.1845 -11.1563 -7.9493 -7.9070 -0.5267 -0.5137 6.8361 6.8757 8.7622 8.8133 9.0323 9.1078 9.3095 9.4305 11.5039 11.5398 15.9949 16.0651 k = 0.5078 0.1377 0.0312 ( 3012 PWs) bands (ev): ************************************-176.0393-176.0286-138.2925-138.2806 -92.7588 -92.7588 -64.3346 -64.3344 -63.4551 -63.4551 -61.5187 -61.5183 -50.8033 -50.7948 -18.7371 -18.7370 -18.6255 -18.6254 -16.7760 -16.7650 -16.4861 -16.4783 -16.4173 -16.4106 -11.1901 -11.1691 -7.9516 -7.9230 -0.5344 -0.5248 6.8530 6.8824 8.7826 8.8171 9.0638 9.1199 9.3700 9.4621 11.4448 11.4741 16.0416 16.0768 k = 0.5052 0.1370 0.0482 ( 3016 PWs) bands (ev): ************************************-176.0401-176.0329-138.2932-138.2849 -92.7595 -92.7595 -64.3345 -64.3344 -63.4551 -63.4551 -61.5189 -61.5186 -50.8780 -50.8719 -18.7398 -18.7397 -18.6282 -18.6281 -16.7814 -16.7741 -16.4843 -16.4791 -16.4167 -16.4124 -11.1942 -11.1796 -7.9545 -7.9305 -0.5420 -0.5354 6.8622 6.8844 8.7949 8.8174 9.0899 9.1266 9.4223 9.4843 11.4010 11.4217 16.0743 16.1052 k = 0.5026 0.1363 0.0651 ( 3019 PWs) bands (ev): ************************************-176.0402-176.0374-138.2942-138.2926 -92.7600 -92.7600 -64.3344 -64.3343 -63.4550 -63.4550 -61.5191 -61.5190 -50.8599 -50.8539 -18.7403 -18.7402 -18.6286 -18.6285 -16.7870 -16.7835 -16.4843 -16.4818 -16.4160 -16.4139 -11.1954 -11.1876 -7.9579 -7.9453 -0.5443 -0.5411 6.8736 6.8849 8.8033 8.8145 9.1093 9.1274 9.4622 9.4934 11.3756 11.3865 16.0988 16.1206 k = 0.5000 0.1356 0.0821 ( 3022 PWs) bands (ev): ************************************-176.0419-176.0419-138.2953-138.2953 -92.7605 -92.7605 -64.3344 -64.3344 -63.4549 -63.4549 -61.5193 -61.5193 -50.9498 -50.9498 -18.7405 -18.7405 -18.6287 -18.6287 -16.7916 -16.7916 -16.4838 -16.4838 -16.4169 -16.4169 -11.1936 -11.1936 -7.9561 -7.9561 -0.5460 -0.5460 6.8761 6.8761 8.8090 8.8090 9.1217 9.1217 9.4864 9.4864 11.3700 11.3700 16.0978 16.1139 k = 0.5000-0.8543-0.5174 ( 3008 PWs) bands (ev): ************************************-176.0424-176.0424-138.2835-138.2835 -92.7426 -92.7426 -64.3883 -64.3883 -63.5092 -63.5092 -61.5114 -61.5114 -50.8870 -50.8870 -18.9837 -18.9837 -18.0464 -18.0464 -16.9409 -16.9409 -16.5592 -16.5592 -15.9899 -15.9899 -8.8217 -8.8217 -7.0150 -7.0150 -2.0136 -2.0136 4.1497 4.1497 6.1186 6.1186 6.5764 6.5764 9.3799 9.3799 11.0706 11.0706 13.2466 13.2466 k = 0.5151-0.8478-0.5135 ( 3006 PWs) bands (ev): ************************************-176.0415-176.0395-138.2825-138.2783 -92.7423 -92.7423 -64.3882 -64.3882 -63.5092 -63.5092 -61.5113 -61.5113 -50.8620 -50.8615 -18.9836 -18.9836 -18.0461 -18.0461 -16.9398 -16.9396 -16.5570 -16.5570 -15.9872 -15.9872 -8.8164 -8.8145 -7.0170 -7.0119 -2.0146 -2.0115 4.1474 4.1508 6.1179 6.1197 6.5706 6.5851 9.3721 9.3846 11.0659 11.0801 13.2415 13.2616 k = 0.5302-0.8414-0.5096 ( 3002 PWs) bands (ev): ************************************-176.0399-176.0366-138.2799-138.2747 -92.7417 -92.7417 -64.3882 -64.3882 -63.5091 -63.5091 -61.5111 -61.5110 -50.7855 -50.7845 -18.9834 -18.9834 -18.0456 -18.0455 -16.9386 -16.9382 -16.5503 -16.5502 -15.9835 -15.9833 -8.8125 -8.8085 -7.0186 -7.0089 -2.0149 -2.0085 4.1440 4.1506 6.1175 6.1211 6.5669 6.5954 9.3607 9.3857 11.0653 11.0940 13.2452 13.2849 k = 0.5452-0.8349-0.5057 ( 3000 PWs) bands (ev): ************************************-176.0378-176.0355-138.2766-138.2740 -92.7413 -92.7413 -64.3881 -64.3881 -63.5091 -63.5090 -61.5110 -61.5110 -50.7826 -50.7807 -18.9832 -18.9832 -18.0439 -18.0439 -16.9373 -16.9366 -16.5475 -16.5475 -15.9835 -15.9832 -8.8080 -8.8012 -7.0213 -7.0072 -2.0146 -2.0050 4.1387 4.1484 6.1170 6.1223 6.5652 6.6074 9.3460 9.3829 11.0679 11.1107 13.2525 13.3105 k = 0.5603-0.8284-0.5018 ( 2992 PWs) bands (ev): ************************************-176.0328-176.0276-138.2699-138.2621 -92.7400 -92.7400 -64.3879 -64.3879 -63.5088 -63.5088 -61.5106 -61.5106 -50.7010 -50.6955 -18.9800 -18.9800 -18.0402 -18.0401 -16.9308 -16.9298 -16.5443 -16.5443 -15.9764 -15.9759 -8.7882 -8.7823 -7.0220 -7.0024 -2.0135 -2.0006 4.1329 4.1455 6.1166 6.1236 6.5668 6.6227 9.3301 9.3779 11.0757 11.1323 13.2695 13.3454 k = 0.5754-0.8220-0.4978 ( 2992 PWs) bands (ev): ************************************-176.0335-176.0289-138.2693-138.2645 -92.7400 -92.7400 -64.3880 -64.3879 -63.5089 -63.5089 -61.5106 -61.5105 -50.6701 -50.6646 -18.9801 -18.9801 -18.0410 -18.0409 -16.9315 -16.9304 -16.5445 -16.5444 -15.9744 -15.9738 -8.7923 -8.7829 -7.0268 -7.0028 -2.0122 -1.9963 4.1250 4.1402 6.1162 6.1247 6.5678 6.6363 9.3105 9.3686 11.0841 11.1530 13.2916 13.3831 k = 0.5905-0.8155-0.4939 ( 2993 PWs) bands (ev): ************************************-176.0358-176.0300-138.2729-138.2654 -92.7401 -92.7401 -64.3879 -64.3879 -63.5089 -63.5088 -61.5107 -61.5106 -50.6936 -50.6866 -18.9785 -18.9784 -18.0421 -18.0419 -16.9345 -16.9332 -16.5459 -16.5459 -15.9739 -15.9732 -8.7967 -8.7855 -7.0324 -7.0029 -2.0104 -1.9914 4.1159 4.1338 6.1156 6.1256 6.5705 6.6506 9.2895 9.3567 11.0941 11.1740 13.3188 13.4243 k = 0.6055-0.8091-0.4900 ( 2995 PWs) bands (ev): ************************************-176.0361-176.0311-138.2724-138.2671 -92.7405 -92.7405 -64.3880 -64.3879 -63.5089 -63.5089 -61.5107 -61.5106 -50.7163 -50.7109 -18.9772 -18.9771 -18.0471 -18.0470 -16.9353 -16.9338 -16.5462 -16.5461 -15.9750 -15.9743 -8.7965 -8.7847 -7.0383 -7.0039 -2.0077 -1.9853 4.1063 4.1261 6.1152 6.1267 6.5751 6.6652 9.2679 9.3431 11.1068 11.1969 13.3510 13.4692 k = 0.6206-0.8026-0.4861 ( 2998 PWs) bands (ev): ************************************-176.0410-176.0339-138.2823-138.2713 -92.7409 -92.7409 -64.3880 -64.3879 -63.5089 -63.5089 -61.5110 -61.5109 -50.7210 -50.7149 -18.9765 -18.9764 -18.0476 -18.0474 -16.9376 -16.9357 -16.5469 -16.5468 -15.9819 -15.9811 -8.8107 -8.7965 -7.0462 -7.0074 -2.0046 -1.9799 4.0953 4.1175 6.1148 6.1275 6.5805 6.6780 9.2471 9.3286 11.1180 11.2171 13.3908 13.5177 k = 0.6357-0.7962-0.4822 ( 3000 PWs) bands (ev): ************************************-176.0422-176.0347-138.2832-138.2703 -92.7413 -92.7413 -64.3881 -64.3880 -63.5090 -63.5090 -61.5111 -61.5110 -50.7966 -50.7913 -18.9777 -18.9777 -18.0480 -18.0478 -16.9435 -16.9413 -16.5474 -16.5472 -15.9796 -15.9787 -8.8111 -8.7959 -7.0523 -7.0084 -2.0014 -1.9737 4.0830 4.1070 6.1144 6.1285 6.5862 6.6912 9.2286 9.3156 11.1302 11.2369 13.4317 13.5650 k = 0.6508-0.7897-0.4783 ( 3007 PWs) bands (ev): ************************************-176.0473-176.0371-138.2912-138.2715 -92.7425 -92.7425 -64.3883 -64.3882 -63.5092 -63.5092 -61.5113 -61.5112 -50.8918 -50.8892 -18.9809 -18.9808 -18.0534 -18.0532 -16.9484 -16.9459 -16.5523 -16.5521 -15.9825 -15.9815 -8.8191 -8.8024 -7.0607 -7.0123 -1.9985 -1.9676 4.0708 4.0954 6.1139 6.1292 6.5908 6.7025 9.2117 9.3027 11.1409 11.2547 13.4785 13.6144 k = 0.6658-0.7833-0.4744 ( 3008 PWs) bands (ev): ************************************-176.0465-176.0382-138.2892-138.2743 -92.7427 -92.7427 -64.3884 -64.3882 -63.5092 -63.5092 -61.5113 -61.5112 -50.8381 -50.8326 -18.9809 -18.9809 -18.0555 -18.0553 -16.9490 -16.9462 -16.5530 -16.5528 -15.9830 -15.9820 -8.8215 -8.8029 -7.0685 -7.0153 -1.9940 -1.9603 4.0594 4.0848 6.1137 6.1301 6.5975 6.7138 9.1989 9.2930 11.1518 11.2712 13.5338 13.6692 k = 0.6809-0.7768-0.4705 ( 3005 PWs) bands (ev): ************************************-176.0454-176.0362-138.2856-138.2692 -92.7422 -92.7422 -64.3883 -64.3881 -63.5092 -63.5091 -61.5112 -61.5110 -50.7960 -50.7885 -18.9793 -18.9792 -18.0552 -18.0550 -16.9438 -16.9406 -16.5520 -16.5519 -15.9837 -15.9828 -8.8122 -8.7916 -7.0752 -7.0169 -1.9884 -1.9521 4.0483 4.0744 6.1136 6.1310 6.6048 6.7238 9.1906 9.2864 11.1616 11.2857 13.5900 13.7221 k = 0.6960-0.7703-0.4666 ( 2999 PWs) bands (ev): ************************************-176.0403-176.0330-138.2800-138.2671 -92.7412 -92.7412 -64.3880 -64.3878 -63.5089 -63.5089 -61.5111 -61.5109 -50.6930 -50.6871 -18.9727 -18.9726 -18.0540 -18.0538 -16.9389 -16.9355 -16.5495 -16.5493 -15.9829 -15.9820 -8.8035 -8.7817 -7.0818 -7.0170 -1.9818 -1.9426 4.0375 4.0645 6.1136 6.1321 6.6111 6.7325 9.1870 9.2828 11.1701 11.2982 13.6479 13.7723 k = 0.7111-0.7639-0.4627 ( 3000 PWs) bands (ev): ************************************-176.0412-176.0336-138.2825-138.2678 -92.7413 -92.7413 -64.3880 -64.3878 -63.5089 -63.5088 -61.5112 -61.5110 -50.6983 -50.6923 -18.9727 -18.9726 -18.0543 -18.0541 -16.9392 -16.9356 -16.5494 -16.5492 -15.9864 -15.9856 -8.8072 -8.7815 -7.0907 -7.0201 -1.9758 -1.9343 4.0262 4.0539 6.1135 6.1329 6.6154 6.7377 9.1857 9.2803 11.1750 11.3063 13.6945 13.8091 k = 0.7261-0.7574-0.4587 ( 3000 PWs) bands (ev): ************************************-176.0414-176.0317-138.2836-138.2638 -92.7414 -92.7414 -64.3880 -64.3878 -63.5089 -63.5088 -61.5112 -61.5110 -50.7007 -50.6871 -18.9737 -18.9736 -18.0545 -18.0542 -16.9392 -16.9355 -16.5491 -16.5489 -15.9858 -15.9850 -8.8043 -8.7760 -7.0987 -7.0234 -1.9690 -1.9254 4.0153 4.0434 6.1134 6.1336 6.6180 6.7403 9.1886 9.2816 11.1774 11.3121 13.7332 13.8392 k = 0.7412-0.7510-0.4548 ( 3000 PWs) bands (ev): ************************************-176.0413-176.0334-138.2811-138.2670 -92.7414 -92.7414 -64.3880 -64.3878 -63.5088 -63.5088 -61.5113 -61.5110 -50.6739 -50.6613 -18.9732 -18.9731 -18.0551 -18.0548 -16.9413 -16.9375 -16.5465 -16.5464 -15.9864 -15.9858 -8.8070 -8.7736 -7.1085 -7.0276 -1.9622 -1.9165 4.0047 4.0335 6.1136 6.1343 6.6194 6.7413 9.1964 9.2865 11.1783 11.3154 13.7526 13.8564 k = 0.7563-0.7445-0.4509 ( 3000 PWs) bands (ev): ************************************-176.0391-176.0318-138.2794-138.2707 -92.7414 -92.7414 -64.3880 -64.3878 -63.5088 -63.5088 -61.5112 -61.5110 -50.7140 -50.7026 -18.9728 -18.9727 -18.0560 -18.0557 -16.9404 -16.9366 -16.5476 -16.5473 -15.9862 -15.9858 -8.8070 -8.7685 -7.1180 -7.0305 -1.9542 -1.9067 3.9955 4.0251 6.1134 6.1348 6.6186 6.7394 9.2068 9.2933 11.1775 11.3166 13.7500 13.8620 k = 0.7714-0.7381-0.4470 ( 2998 PWs) bands (ev): ************************************-176.0374-176.0286-138.2772-138.2670 -92.7411 -92.7411 -64.3879 -64.3877 -63.5088 -63.5087 -61.5112 -61.5109 -50.6944 -50.6852 -18.9727 -18.9727 -18.0550 -18.0547 -16.9387 -16.9347 -16.5453 -16.5450 -15.9863 -15.9858 -8.8003 -8.7595 -7.1268 -7.0327 -1.9466 -1.8973 3.9866 4.0175 6.1136 6.1357 6.6174 6.7361 9.2213 9.3042 11.1749 11.3157 13.7311 13.8588 k = 0.7864-0.7316-0.4431 ( 3001 PWs) bands (ev): ************************************-176.0421-176.0299-138.2858-138.2688 -92.7416 -92.7416 -64.3880 -64.3877 -63.5088 -63.5087 -61.5114 -61.5111 -50.7401 -50.7288 -18.9729 -18.9728 -18.0559 -18.0556 -16.9431 -16.9390 -16.5471 -16.5468 -15.9888 -15.9883 -8.8098 -8.7668 -7.1385 -7.0375 -1.9393 -1.8884 3.9778 4.0100 6.1135 6.1360 6.6128 6.7301 9.2364 9.3161 11.1700 11.3122 13.6973 13.8416 k = 0.8015-0.7252-0.4392 ( 2997 PWs) bands (ev): ************************************-176.0404-176.0275-138.2848-138.2634 -92.7410 -92.7410 -64.3878 -64.3876 -63.5086 -63.5086 -61.5112 -61.5109 -50.6925 -50.6822 -18.9727 -18.9726 -18.0519 -18.0516 -16.9430 -16.9389 -16.5457 -16.5454 -15.9826 -15.9818 -8.8062 -8.7566 -7.1481 -7.0401 -1.9310 -1.8786 3.9711 4.0047 6.1139 6.1367 6.6088 6.7237 9.2545 9.3314 11.1650 11.3081 13.6566 13.8160 k = 0.8166-0.7187-0.4353 ( 2999 PWs) bands (ev): ************************************-176.0403-176.0301-138.2833-138.2686 -92.7414 -92.7414 -64.3879 -64.3876 -63.5087 -63.5087 -61.5112 -61.5109 -50.6944 -50.6839 -18.9745 -18.9744 -18.0542 -18.0539 -16.9446 -16.9404 -16.5479 -16.5476 -15.9804 -15.9795 -8.8123 -8.7579 -7.1590 -7.0446 -1.9237 -1.8694 3.9642 3.9993 6.1140 6.1372 6.6020 6.7156 9.2722 9.3463 11.1595 11.3032 13.6116 13.7810 Writing output data file CrWN2.save init_run : 0.39s CPU 0.68s WALL ( 1 calls) electrons : 2708.86s CPU 2856.21s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.04s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 2708.85s CPU 2856.20s 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 : 0.04s CPU 0.04s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.03s WALL ( 420 calls) cegterg : 2315.79s CPU 2429.89s WALL ( 2520 calls) Called by sum_band: Called by *egterg: h_psi : 1726.17s CPU 1829.75s WALL ( 53340 calls) s_psi : 20.30s CPU 21.52s WALL ( 53340 calls) g_psi : 0.64s CPU 0.96s WALL ( 50400 calls) cdiaghg : 419.29s CPU 419.93s WALL ( 50820 calls) cegterg:over : 73.76s CPU 75.72s WALL ( 50400 calls) cegterg:upda : 6.08s CPU 15.55s WALL ( 50400 calls) cegterg:last : 7.25s CPU 12.04s WALL ( 11046 calls) Called by h_psi: h_psi:vloc : 1669.29s CPU 1757.29s WALL ( 53340 calls) h_psi:vnl : 56.75s CPU 71.83s WALL ( 53340 calls) add_vuspsi : 22.36s CPU 28.87s WALL ( 53340 calls) General routines calbec : 34.34s CPU 42.83s WALL ( 53340 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 1660.40s CPU 1729.88s WALL ( 5827440 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.00s CPU 22.60s WALL ( 840 calls) Parallel routines fft_scatter : 1522.60s CPU 1316.42s WALL ( 5827463 calls) PWSCF : 46m32.99s CPU 55m 5.60s WALL This run was terminated on: 7:41:19 30Nov2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=