Program PWSCF v.5.3.0 (svn rev. 11974) starts on 1Feb2017 at 6:59:28 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./LiP.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 45 45 12 3296 3296 471 Max 46 46 13 3302 3302 479 Sum 3241 3241 877 237627 237627 34075 bravais-lattice index = 14 lattice parameter (alat) = 9.3352 a.u. unit-cell volume = 1682.5866 (a.u.)^3 number of atoms/cell = 16 number of atomic types = 2 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 412.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.335246 celldm(2)= 1.129960 celldm(3)= 2.075911 celldm(4)= 0.471782 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.129960 0.000000 ) a(3) = ( 0.000000 0.979376 1.830363 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.884987 -0.473532 ) b(3) = ( 0.000000 0.000000 0.546340 ) PseudoPot. # 1 for Li read from file: /users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 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 1147 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Li 3.00 6.94100 Li( 1.00) P 5.00 30.97380 P( 1.00) 2 Sym. Ops., with inversion, found (note: 2 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 235 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042553 k( 2) = ( 0.0000000 0.0000000 0.0151761), wk = 0.0042553 k( 3) = ( 0.0000000 0.0000000 0.0303522), wk = 0.0042553 k( 4) = ( 0.0000000 0.0000000 0.0455283), wk = 0.0042553 k( 5) = ( 0.0000000 0.0000000 0.0607044), wk = 0.0042553 k( 6) = ( 0.0000000 0.0000000 0.0758805), wk = 0.0042553 k( 7) = ( 0.0000000 0.0000000 0.0910566), wk = 0.0042553 k( 8) = ( 0.0000000 0.0000000 0.1062327), wk = 0.0042553 k( 9) = ( 0.0000000 0.0000000 0.1214088), wk = 0.0042553 k( 10) = ( 0.0000000 0.0000000 0.1365849), wk = 0.0042553 k( 11) = ( 0.0000000 0.0000000 0.1517610), wk = 0.0042553 k( 12) = ( 0.0000000 0.0000000 0.1669372), wk = 0.0042553 k( 13) = ( 0.0000000 0.0000000 0.1821133), wk = 0.0042553 k( 14) = ( 0.0000000 0.0000000 0.1972894), wk = 0.0042553 k( 15) = ( 0.0000000 0.0000000 0.2124655), wk = 0.0042553 k( 16) = ( 0.0000000 0.0000000 0.2276416), wk = 0.0042553 k( 17) = ( 0.0000000 0.0000000 0.2428177), wk = 0.0042553 k( 18) = ( 0.0000000 0.0000000 0.2579938), wk = 0.0042553 k( 19) = ( 0.0000000 0.0000000 0.2731699), wk = 0.0042553 k( 20) = ( 0.0000000 0.0000000 0.2731699), wk = 0.0042553 k( 21) = ( 0.0000000 0.0156672 0.2731699), wk = 0.0042553 k( 22) = ( 0.0000000 0.0313345 0.2731699), wk = 0.0042553 k( 23) = ( 0.0000000 0.0470017 0.2731699), wk = 0.0042553 k( 24) = ( 0.0000000 0.0626689 0.2731699), wk = 0.0042553 k( 25) = ( 0.0000000 0.0783361 0.2731699), wk = 0.0042553 k( 26) = ( 0.0000000 0.0940034 0.2731699), wk = 0.0042553 k( 27) = ( 0.0000000 0.1096706 0.2731699), wk = 0.0042553 k( 28) = ( 0.0000000 0.1253378 0.2731699), wk = 0.0042553 k( 29) = ( 0.0000000 0.1410050 0.2731699), wk = 0.0042553 k( 30) = ( 0.0000000 0.1566723 0.2731699), wk = 0.0042553 k( 31) = ( 0.0000000 0.1723395 0.2731699), wk = 0.0042553 k( 32) = ( 0.0000000 0.1880067 0.2731699), wk = 0.0042553 k( 33) = ( 0.0000000 0.2036739 0.2731699), wk = 0.0042553 k( 34) = ( 0.0000000 0.2193412 0.2731699), wk = 0.0042553 k( 35) = ( 0.0000000 0.2350084 0.2731699), wk = 0.0042553 k( 36) = ( 0.0000000 0.2506756 0.2731699), wk = 0.0042553 k( 37) = ( 0.0000000 0.2663428 0.2731699), wk = 0.0042553 k( 38) = ( 0.0000000 0.2820101 0.2731699), wk = 0.0042553 k( 39) = ( 0.0000000 0.2976773 0.2731699), wk = 0.0042553 k( 40) = ( 0.0000000 0.3133445 0.2731699), wk = 0.0042553 k( 41) = ( 0.0000000 0.3290117 0.2731699), wk = 0.0042553 k( 42) = ( 0.0000000 0.3446790 0.2731699), wk = 0.0042553 k( 43) = ( 0.0000000 0.3603462 0.2731699), wk = 0.0042553 k( 44) = ( 0.0000000 0.3760134 0.2731699), wk = 0.0042553 k( 45) = ( 0.0000000 0.3916806 0.2731699), wk = 0.0042553 k( 46) = ( 0.0000000 0.4073479 0.2731699), wk = 0.0042553 k( 47) = ( 0.0000000 0.4230151 0.2731699), wk = 0.0042553 k( 48) = ( 0.0000000 0.4230151 0.2731699), wk = 0.0042553 k( 49) = ( 0.0000000 0.4242325 0.2583720), wk = 0.0042553 k( 50) = ( 0.0000000 0.4254499 0.2435741), wk = 0.0042553 k( 51) = ( 0.0000000 0.4266673 0.2287762), wk = 0.0042553 k( 52) = ( 0.0000000 0.4278847 0.2139784), wk = 0.0042553 k( 53) = ( 0.0000000 0.4291022 0.1991805), wk = 0.0042553 k( 54) = ( 0.0000000 0.4303196 0.1843826), wk = 0.0042553 k( 55) = ( 0.0000000 0.4315370 0.1695847), wk = 0.0042553 k( 56) = ( 0.0000000 0.4327544 0.1547868), wk = 0.0042553 k( 57) = ( 0.0000000 0.4339718 0.1399889), wk = 0.0042553 k( 58) = ( 0.0000000 0.4351892 0.1251911), wk = 0.0042553 k( 59) = ( 0.0000000 0.4364067 0.1103932), wk = 0.0042553 k( 60) = ( 0.0000000 0.4376241 0.0955953), wk = 0.0042553 k( 61) = ( 0.0000000 0.4388415 0.0807974), wk = 0.0042553 k( 62) = ( 0.0000000 0.4400589 0.0659995), wk = 0.0042553 k( 63) = ( 0.0000000 0.4412763 0.0512016), wk = 0.0042553 k( 64) = ( 0.0000000 0.4424937 0.0364038), wk = 0.0042553 k( 65) = ( 0.0000000 0.4424937 0.0364038), wk = 0.0042553 k( 66) = ( 0.0156250 0.4424937 0.0364038), wk = 0.0042553 k( 67) = ( 0.0312500 0.4424937 0.0364038), wk = 0.0042553 k( 68) = ( 0.0468750 0.4424937 0.0364038), wk = 0.0042553 k( 69) = ( 0.0625000 0.4424937 0.0364038), wk = 0.0042553 k( 70) = ( 0.0781250 0.4424937 0.0364038), wk = 0.0042553 k( 71) = ( 0.0937500 0.4424937 0.0364038), wk = 0.0042553 k( 72) = ( 0.1093750 0.4424937 0.0364038), wk = 0.0042553 k( 73) = ( 0.1250000 0.4424937 0.0364038), wk = 0.0042553 k( 74) = ( 0.1406250 0.4424937 0.0364038), wk = 0.0042553 k( 75) = ( 0.1562500 0.4424937 0.0364038), wk = 0.0042553 k( 76) = ( 0.1718750 0.4424937 0.0364038), wk = 0.0042553 k( 77) = ( 0.1875000 0.4424937 0.0364038), wk = 0.0042553 k( 78) = ( 0.2031250 0.4424937 0.0364038), wk = 0.0042553 k( 79) = ( 0.2187500 0.4424937 0.0364038), wk = 0.0042553 k( 80) = ( 0.2343750 0.4424937 0.0364038), wk = 0.0042553 k( 81) = ( 0.2500000 0.4424937 0.0364038), wk = 0.0042553 k( 82) = ( 0.2656250 0.4424937 0.0364038), wk = 0.0042553 k( 83) = ( 0.2812500 0.4424937 0.0364038), wk = 0.0042553 k( 84) = ( 0.2968750 0.4424937 0.0364038), wk = 0.0042553 k( 85) = ( 0.3125000 0.4424937 0.0364038), wk = 0.0042553 k( 86) = ( 0.3281250 0.4424937 0.0364038), wk = 0.0042553 k( 87) = ( 0.3437500 0.4424937 0.0364038), wk = 0.0042553 k( 88) = ( 0.3593750 0.4424937 0.0364038), wk = 0.0042553 k( 89) = ( 0.3750000 0.4424937 0.0364038), wk = 0.0042553 k( 90) = ( 0.3906250 0.4424937 0.0364038), wk = 0.0042553 k( 91) = ( 0.4062500 0.4424937 0.0364038), wk = 0.0042553 k( 92) = ( 0.4218750 0.4424937 0.0364038), wk = 0.0042553 k( 93) = ( 0.4375000 0.4424937 0.0364038), wk = 0.0042553 k( 94) = ( 0.4531250 0.4424937 0.0364038), wk = 0.0042553 k( 95) = ( 0.4687500 0.4424937 0.0364038), wk = 0.0042553 k( 96) = ( 0.4843750 0.4424937 0.0364038), wk = 0.0042553 k( 97) = ( 0.5000000 0.4424937 0.0364038), wk = 0.0042553 k( 98) = ( 0.5000000 0.4424937 0.0364038), wk = 0.0042553 k( 99) = ( 0.5000000 0.4437111 0.0216059), wk = 0.0042553 k( 100) = ( 0.5000000 0.4449286 0.0068080), wk = 0.0042553 k( 101) = ( 0.5000000 0.4461460 -0.0079899), wk = 0.0042553 k( 102) = ( 0.5000000 0.4473634 -0.0227878), wk = 0.0042553 k( 103) = ( 0.5000000 0.4485808 -0.0375856), wk = 0.0042553 k( 104) = ( 0.5000000 0.4497982 -0.0523835), wk = 0.0042553 k( 105) = ( 0.5000000 0.4510156 -0.0671814), wk = 0.0042553 k( 106) = ( 0.5000000 0.4522331 -0.0819793), wk = 0.0042553 k( 107) = ( 0.5000000 0.4534505 -0.0967772), wk = 0.0042553 k( 108) = ( 0.5000000 0.4546679 -0.1115751), wk = 0.0042553 k( 109) = ( 0.5000000 0.4558853 -0.1263729), wk = 0.0042553 k( 110) = ( 0.5000000 0.4571027 -0.1411708), wk = 0.0042553 k( 111) = ( 0.5000000 0.4583201 -0.1559687), wk = 0.0042553 k( 112) = ( 0.5000000 0.4595375 -0.1707666), wk = 0.0042553 k( 113) = ( 0.5000000 0.4607550 -0.1855645), wk = 0.0042553 k( 114) = ( 0.5000000 0.4619724 -0.2003624), wk = 0.0042553 k( 115) = ( 0.5000000 0.4619724 -0.2003624), wk = 0.0042553 k( 116) = ( 0.5000000 0.4554795 -0.2124969), wk = 0.0042553 k( 117) = ( 0.5000000 0.4489866 -0.2246315), wk = 0.0042553 k( 118) = ( 0.5000000 0.4424937 -0.2367661), wk = 0.0042553 k( 119) = ( 0.5000000 0.4424937 -0.2367661), wk = 0.0042553 k( 120) = ( 0.4843750 0.4424937 -0.2367661), wk = 0.0042553 k( 121) = ( 0.4687500 0.4424937 -0.2367661), wk = 0.0042553 k( 122) = ( 0.4531250 0.4424937 -0.2367661), wk = 0.0042553 k( 123) = ( 0.4375000 0.4424937 -0.2367661), wk = 0.0042553 k( 124) = ( 0.4218750 0.4424937 -0.2367661), wk = 0.0042553 k( 125) = ( 0.4062500 0.4424937 -0.2367661), wk = 0.0042553 k( 126) = ( 0.3906250 0.4424937 -0.2367661), wk = 0.0042553 k( 127) = ( 0.3750000 0.4424937 -0.2367661), wk = 0.0042553 k( 128) = ( 0.3593750 0.4424937 -0.2367661), wk = 0.0042553 k( 129) = ( 0.3437500 0.4424937 -0.2367661), wk = 0.0042553 k( 130) = ( 0.3281250 0.4424937 -0.2367661), wk = 0.0042553 k( 131) = ( 0.3125000 0.4424937 -0.2367661), wk = 0.0042553 k( 132) = ( 0.2968750 0.4424937 -0.2367661), wk = 0.0042553 k( 133) = ( 0.2812500 0.4424937 -0.2367661), wk = 0.0042553 k( 134) = ( 0.2656250 0.4424937 -0.2367661), wk = 0.0042553 k( 135) = ( 0.2500000 0.4424937 -0.2367661), wk = 0.0042553 k( 136) = ( 0.2343750 0.4424937 -0.2367661), wk = 0.0042553 k( 137) = ( 0.2187500 0.4424937 -0.2367661), wk = 0.0042553 k( 138) = ( 0.2031250 0.4424937 -0.2367661), wk = 0.0042553 k( 139) = ( 0.1875000 0.4424937 -0.2367661), wk = 0.0042553 k( 140) = ( 0.1718750 0.4424937 -0.2367661), wk = 0.0042553 k( 141) = ( 0.1562500 0.4424937 -0.2367661), wk = 0.0042553 k( 142) = ( 0.1406250 0.4424937 -0.2367661), wk = 0.0042553 k( 143) = ( 0.1250000 0.4424937 -0.2367661), wk = 0.0042553 k( 144) = ( 0.1093750 0.4424937 -0.2367661), wk = 0.0042553 k( 145) = ( 0.0937500 0.4424937 -0.2367661), wk = 0.0042553 k( 146) = ( 0.0781250 0.4424937 -0.2367661), wk = 0.0042553 k( 147) = ( 0.0625000 0.4424937 -0.2367661), wk = 0.0042553 k( 148) = ( 0.0468750 0.4424937 -0.2367661), wk = 0.0042553 k( 149) = ( 0.0312500 0.4424937 -0.2367661), wk = 0.0042553 k( 150) = ( 0.0156250 0.4424937 -0.2367661), wk = 0.0042553 k( 151) = ( 0.0000000 0.4424937 -0.2367661), wk = 0.0042553 k( 152) = ( 0.0000000 0.4424937 -0.2367661), wk = 0.0042553 k( 153) = ( 0.0000000 0.4489866 -0.2246315), wk = 0.0042553 k( 154) = ( 0.0000000 0.4554795 -0.2124969), wk = 0.0042553 k( 155) = ( 0.0000000 0.4619724 -0.2003624), wk = 0.0042553 k( 156) = ( 0.5000000 0.4230151 0.2731699), wk = 0.0042553 k( 157) = ( 0.5000000 0.4073479 0.2731699), wk = 0.0042553 k( 158) = ( 0.5000000 0.3916806 0.2731699), wk = 0.0042553 k( 159) = ( 0.5000000 0.3760134 0.2731699), wk = 0.0042553 k( 160) = ( 0.5000000 0.3603462 0.2731699), wk = 0.0042553 k( 161) = ( 0.5000000 0.3446790 0.2731699), wk = 0.0042553 k( 162) = ( 0.5000000 0.3290117 0.2731699), wk = 0.0042553 k( 163) = ( 0.5000000 0.3133445 0.2731699), wk = 0.0042553 k( 164) = ( 0.5000000 0.2976773 0.2731699), wk = 0.0042553 k( 165) = ( 0.5000000 0.2820101 0.2731699), wk = 0.0042553 k( 166) = ( 0.5000000 0.2663428 0.2731699), wk = 0.0042553 k( 167) = ( 0.5000000 0.2506756 0.2731699), wk = 0.0042553 k( 168) = ( 0.5000000 0.2350084 0.2731699), wk = 0.0042553 k( 169) = ( 0.5000000 0.2193412 0.2731699), wk = 0.0042553 k( 170) = ( 0.5000000 0.2036739 0.2731699), wk = 0.0042553 k( 171) = ( 0.5000000 0.1880067 0.2731699), wk = 0.0042553 k( 172) = ( 0.5000000 0.1723395 0.2731699), wk = 0.0042553 k( 173) = ( 0.5000000 0.1566723 0.2731699), wk = 0.0042553 k( 174) = ( 0.5000000 0.1410050 0.2731699), wk = 0.0042553 k( 175) = ( 0.5000000 0.1253378 0.2731699), wk = 0.0042553 k( 176) = ( 0.5000000 0.1096706 0.2731699), wk = 0.0042553 k( 177) = ( 0.5000000 0.0940034 0.2731699), wk = 0.0042553 k( 178) = ( 0.5000000 0.0783361 0.2731699), wk = 0.0042553 k( 179) = ( 0.5000000 0.0626689 0.2731699), wk = 0.0042553 k( 180) = ( 0.5000000 0.0470017 0.2731699), wk = 0.0042553 k( 181) = ( 0.5000000 0.0313345 0.2731699), wk = 0.0042553 k( 182) = ( 0.5000000 0.0156672 0.2731699), wk = 0.0042553 k( 183) = ( 0.5000000 -0.0000000 0.2731699), wk = 0.0042553 k( 184) = ( 0.5000000 -0.0000000 0.2731699), wk = 0.0042553 k( 185) = ( 0.5000000 -0.0000000 0.2579938), wk = 0.0042553 k( 186) = ( 0.5000000 -0.0000000 0.2428177), wk = 0.0042553 k( 187) = ( 0.5000000 -0.0000000 0.2276416), wk = 0.0042553 k( 188) = ( 0.5000000 -0.0000000 0.2124655), wk = 0.0042553 k( 189) = ( 0.5000000 -0.0000000 0.1972894), wk = 0.0042553 k( 190) = ( 0.5000000 -0.0000000 0.1821133), wk = 0.0042553 k( 191) = ( 0.5000000 -0.0000000 0.1669372), wk = 0.0042553 k( 192) = ( 0.5000000 -0.0000000 0.1517610), wk = 0.0042553 k( 193) = ( 0.5000000 -0.0000000 0.1365849), wk = 0.0042553 k( 194) = ( 0.5000000 -0.0000000 0.1214088), wk = 0.0042553 k( 195) = ( 0.5000000 -0.0000000 0.1062327), wk = 0.0042553 k( 196) = ( 0.5000000 -0.0000000 0.0910566), wk = 0.0042553 k( 197) = ( 0.5000000 -0.0000000 0.0758805), wk = 0.0042553 k( 198) = ( 0.5000000 -0.0000000 0.0607044), wk = 0.0042553 k( 199) = ( 0.5000000 -0.0000000 0.0455283), wk = 0.0042553 k( 200) = ( 0.5000000 -0.0000000 0.0303522), wk = 0.0042553 k( 201) = ( 0.5000000 -0.0000000 0.0151761), wk = 0.0042553 k( 202) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0042553 k( 203) = ( 0.0000000 0.0000000 0.2731699), wk = 0.0042553 k( 204) = ( 0.0156250 -0.0000000 0.2731699), wk = 0.0042553 k( 205) = ( 0.0312500 -0.0000000 0.2731699), wk = 0.0042553 k( 206) = ( 0.0468750 -0.0000000 0.2731699), wk = 0.0042553 k( 207) = ( 0.0625000 -0.0000000 0.2731699), wk = 0.0042553 k( 208) = ( 0.0781250 -0.0000000 0.2731699), wk = 0.0042553 k( 209) = ( 0.0937500 -0.0000000 0.2731699), wk = 0.0042553 k( 210) = ( 0.1093750 -0.0000000 0.2731699), wk = 0.0042553 k( 211) = ( 0.1250000 -0.0000000 0.2731699), wk = 0.0042553 k( 212) = ( 0.1406250 -0.0000000 0.2731699), wk = 0.0042553 k( 213) = ( 0.1562500 -0.0000000 0.2731699), wk = 0.0042553 k( 214) = ( 0.1718750 -0.0000000 0.2731699), wk = 0.0042553 k( 215) = ( 0.1875000 -0.0000000 0.2731699), wk = 0.0042553 k( 216) = ( 0.2031250 -0.0000000 0.2731699), wk = 0.0042553 k( 217) = ( 0.2187500 -0.0000000 0.2731699), wk = 0.0042553 k( 218) = ( 0.2343750 -0.0000000 0.2731699), wk = 0.0042553 k( 219) = ( 0.2500000 -0.0000000 0.2731699), wk = 0.0042553 k( 220) = ( 0.2656250 -0.0000000 0.2731699), wk = 0.0042553 k( 221) = ( 0.2812500 -0.0000000 0.2731699), wk = 0.0042553 k( 222) = ( 0.2968750 -0.0000000 0.2731699), wk = 0.0042553 k( 223) = ( 0.3125000 -0.0000000 0.2731699), wk = 0.0042553 k( 224) = ( 0.3281250 -0.0000000 0.2731699), wk = 0.0042553 k( 225) = ( 0.3437500 -0.0000000 0.2731699), wk = 0.0042553 k( 226) = ( 0.3593750 -0.0000000 0.2731699), wk = 0.0042553 k( 227) = ( 0.3750000 -0.0000000 0.2731699), wk = 0.0042553 k( 228) = ( 0.3906250 -0.0000000 0.2731699), wk = 0.0042553 k( 229) = ( 0.4062500 -0.0000000 0.2731699), wk = 0.0042553 k( 230) = ( 0.4218750 -0.0000000 0.2731699), wk = 0.0042553 k( 231) = ( 0.4375000 -0.0000000 0.2731699), wk = 0.0042553 k( 232) = ( 0.4531250 -0.0000000 0.2731699), wk = 0.0042553 k( 233) = ( 0.4687500 -0.0000000 0.2731699), wk = 0.0042553 k( 234) = ( 0.4843750 -0.0000000 0.2731699), wk = 0.0042553 k( 235) = ( 0.5000000 -0.0000000 0.2731699), wk = 0.0042553 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042553 k( 2) = ( 0.0000000 0.0000000 0.0277778), wk = 0.0042553 k( 3) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0042553 k( 4) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0042553 k( 5) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0042553 k( 6) = ( 0.0000000 0.0000000 0.1388889), wk = 0.0042553 k( 7) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0042553 k( 8) = ( 0.0000000 0.0000000 0.1944444), wk = 0.0042553 k( 9) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0042553 k( 10) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0042553 k( 11) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0042553 k( 12) = ( 0.0000000 0.0000000 0.3055556), wk = 0.0042553 k( 13) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0042553 k( 14) = ( 0.0000000 0.0000000 0.3611111), wk = 0.0042553 k( 15) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0042553 k( 16) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0042553 k( 17) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0042553 k( 18) = ( 0.0000000 0.0000000 0.4722222), wk = 0.0042553 k( 19) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0042553 k( 20) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0042553 k( 21) = ( 0.0000000 0.0177033 0.5153441), wk = 0.0042553 k( 22) = ( 0.0000000 0.0354067 0.5306882), wk = 0.0042553 k( 23) = ( 0.0000000 0.0531100 0.5460323), wk = 0.0042553 k( 24) = ( 0.0000000 0.0708133 0.5613764), wk = 0.0042553 k( 25) = ( 0.0000000 0.0885167 0.5767205), wk = 0.0042553 k( 26) = ( 0.0000000 0.1062200 0.5920647), wk = 0.0042553 k( 27) = ( 0.0000000 0.1239233 0.6074088), wk = 0.0042553 k( 28) = ( 0.0000000 0.1416266 0.6227529), wk = 0.0042553 k( 29) = ( 0.0000000 0.1593300 0.6380970), wk = 0.0042553 k( 30) = ( 0.0000000 0.1770333 0.6534411), wk = 0.0042553 k( 31) = ( 0.0000000 0.1947366 0.6687852), wk = 0.0042553 k( 32) = ( 0.0000000 0.2124400 0.6841293), wk = 0.0042553 k( 33) = ( 0.0000000 0.2301433 0.6994734), wk = 0.0042553 k( 34) = ( 0.0000000 0.2478466 0.7148175), wk = 0.0042553 k( 35) = ( 0.0000000 0.2655500 0.7301617), wk = 0.0042553 k( 36) = ( 0.0000000 0.2832533 0.7455058), wk = 0.0042553 k( 37) = ( 0.0000000 0.3009566 0.7608499), wk = 0.0042553 k( 38) = ( 0.0000000 0.3186599 0.7761940), wk = 0.0042553 k( 39) = ( 0.0000000 0.3363633 0.7915381), wk = 0.0042553 k( 40) = ( 0.0000000 0.3540666 0.8068822), wk = 0.0042553 k( 41) = ( 0.0000000 0.3717699 0.8222263), wk = 0.0042553 k( 42) = ( 0.0000000 0.3894733 0.8375704), wk = 0.0042553 k( 43) = ( 0.0000000 0.4071766 0.8529145), wk = 0.0042553 k( 44) = ( 0.0000000 0.4248799 0.8682586), wk = 0.0042553 k( 45) = ( 0.0000000 0.4425833 0.8836028), wk = 0.0042553 k( 46) = ( 0.0000000 0.4602866 0.8989469), wk = 0.0042553 k( 47) = ( 0.0000000 0.4779899 0.9142910), wk = 0.0042553 k( 48) = ( 0.0000000 0.4779899 0.9142910), wk = 0.0042553 k( 49) = ( 0.0000000 0.4793655 0.8883978), wk = 0.0042553 k( 50) = ( 0.0000000 0.4807412 0.8625046), wk = 0.0042553 k( 51) = ( 0.0000000 0.4821168 0.8366114), wk = 0.0042553 k( 52) = ( 0.0000000 0.4834924 0.8107182), wk = 0.0042553 k( 53) = ( 0.0000000 0.4848681 0.7848250), wk = 0.0042553 k( 54) = ( 0.0000000 0.4862437 0.7589319), wk = 0.0042553 k( 55) = ( 0.0000000 0.4876193 0.7330387), wk = 0.0042553 k( 56) = ( 0.0000000 0.4889950 0.7071455), wk = 0.0042553 k( 57) = ( 0.0000000 0.4903706 0.6812523), wk = 0.0042553 k( 58) = ( 0.0000000 0.4917462 0.6553591), wk = 0.0042553 k( 59) = ( 0.0000000 0.4931218 0.6294659), wk = 0.0042553 k( 60) = ( 0.0000000 0.4944975 0.6035727), wk = 0.0042553 k( 61) = ( 0.0000000 0.4958731 0.5776796), wk = 0.0042553 k( 62) = ( 0.0000000 0.4972487 0.5517864), wk = 0.0042553 k( 63) = ( 0.0000000 0.4986244 0.5258932), wk = 0.0042553 k( 64) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0042553 k( 65) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0042553 k( 66) = ( 0.0156250 0.5000000 0.5000000), wk = 0.0042553 k( 67) = ( 0.0312500 0.5000000 0.5000000), wk = 0.0042553 k( 68) = ( 0.0468750 0.5000000 0.5000000), wk = 0.0042553 k( 69) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0042553 k( 70) = ( 0.0781250 0.5000000 0.5000000), wk = 0.0042553 k( 71) = ( 0.0937500 0.5000000 0.5000000), wk = 0.0042553 k( 72) = ( 0.1093750 0.5000000 0.5000000), wk = 0.0042553 k( 73) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0042553 k( 74) = ( 0.1406250 0.5000000 0.5000000), wk = 0.0042553 k( 75) = ( 0.1562500 0.5000000 0.5000000), wk = 0.0042553 k( 76) = ( 0.1718750 0.5000000 0.5000000), wk = 0.0042553 k( 77) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0042553 k( 78) = ( 0.2031250 0.5000000 0.5000000), wk = 0.0042553 k( 79) = ( 0.2187500 0.5000000 0.5000000), wk = 0.0042553 k( 80) = ( 0.2343750 0.5000000 0.5000000), wk = 0.0042553 k( 81) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0042553 k( 82) = ( 0.2656250 0.5000000 0.5000000), wk = 0.0042553 k( 83) = ( 0.2812500 0.5000000 0.5000000), wk = 0.0042553 k( 84) = ( 0.2968750 0.5000000 0.5000000), wk = 0.0042553 k( 85) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0042553 k( 86) = ( 0.3281250 0.5000000 0.5000000), wk = 0.0042553 k( 87) = ( 0.3437500 0.5000000 0.5000000), wk = 0.0042553 k( 88) = ( 0.3593750 0.5000000 0.5000000), wk = 0.0042553 k( 89) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0042553 k( 90) = ( 0.3906250 0.5000000 0.5000000), wk = 0.0042553 k( 91) = ( 0.4062500 0.5000000 0.5000000), wk = 0.0042553 k( 92) = ( 0.4218750 0.5000000 0.5000000), wk = 0.0042553 k( 93) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0042553 k( 94) = ( 0.4531250 0.5000000 0.5000000), wk = 0.0042553 k( 95) = ( 0.4687500 0.5000000 0.5000000), wk = 0.0042553 k( 96) = ( 0.4843750 0.5000000 0.5000000), wk = 0.0042553 k( 97) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0042553 k( 98) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0042553 k( 99) = ( 0.5000000 0.5013756 0.4741068), wk = 0.0042553 k( 100) = ( 0.5000000 0.5027513 0.4482136), wk = 0.0042553 k( 101) = ( 0.5000000 0.5041269 0.4223204), wk = 0.0042553 k( 102) = ( 0.5000000 0.5055025 0.3964273), wk = 0.0042553 k( 103) = ( 0.5000000 0.5068782 0.3705341), wk = 0.0042553 k( 104) = ( 0.5000000 0.5082538 0.3446409), wk = 0.0042553 k( 105) = ( 0.5000000 0.5096294 0.3187477), wk = 0.0042553 k( 106) = ( 0.5000000 0.5110050 0.2928545), wk = 0.0042553 k( 107) = ( 0.5000000 0.5123807 0.2669613), wk = 0.0042553 k( 108) = ( 0.5000000 0.5137563 0.2410681), wk = 0.0042553 k( 109) = ( 0.5000000 0.5151319 0.2151749), wk = 0.0042553 k( 110) = ( 0.5000000 0.5165076 0.1892818), wk = 0.0042553 k( 111) = ( 0.5000000 0.5178832 0.1633886), wk = 0.0042553 k( 112) = ( 0.5000000 0.5192588 0.1374954), wk = 0.0042553 k( 113) = ( 0.5000000 0.5206344 0.1116022), wk = 0.0042553 k( 114) = ( 0.5000000 0.5220101 0.0857090), wk = 0.0042553 k( 115) = ( 0.5000000 0.5220101 0.0857090), wk = 0.0042553 k( 116) = ( 0.5000000 0.5146734 0.0571393), wk = 0.0042553 k( 117) = ( 0.5000000 0.5073367 0.0285697), wk = 0.0042553 k( 118) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0042553 k( 119) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0042553 k( 120) = ( 0.4843750 0.5000000 -0.0000000), wk = 0.0042553 k( 121) = ( 0.4687500 0.5000000 -0.0000000), wk = 0.0042553 k( 122) = ( 0.4531250 0.5000000 -0.0000000), wk = 0.0042553 k( 123) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0042553 k( 124) = ( 0.4218750 0.5000000 -0.0000000), wk = 0.0042553 k( 125) = ( 0.4062500 0.5000000 -0.0000000), wk = 0.0042553 k( 126) = ( 0.3906250 0.5000000 -0.0000000), wk = 0.0042553 k( 127) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0042553 k( 128) = ( 0.3593750 0.5000000 -0.0000000), wk = 0.0042553 k( 129) = ( 0.3437500 0.5000000 -0.0000000), wk = 0.0042553 k( 130) = ( 0.3281250 0.5000000 -0.0000000), wk = 0.0042553 k( 131) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0042553 k( 132) = ( 0.2968750 0.5000000 -0.0000000), wk = 0.0042553 k( 133) = ( 0.2812500 0.5000000 -0.0000000), wk = 0.0042553 k( 134) = ( 0.2656250 0.5000000 -0.0000000), wk = 0.0042553 k( 135) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0042553 k( 136) = ( 0.2343750 0.5000000 -0.0000000), wk = 0.0042553 k( 137) = ( 0.2187500 0.5000000 0.0000000), wk = 0.0042553 k( 138) = ( 0.2031250 0.5000000 0.0000000), wk = 0.0042553 k( 139) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0042553 k( 140) = ( 0.1718750 0.5000000 0.0000000), wk = 0.0042553 k( 141) = ( 0.1562500 0.5000000 0.0000000), wk = 0.0042553 k( 142) = ( 0.1406250 0.5000000 0.0000000), wk = 0.0042553 k( 143) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0042553 k( 144) = ( 0.1093750 0.5000000 -0.0000000), wk = 0.0042553 k( 145) = ( 0.0937500 0.5000000 -0.0000000), wk = 0.0042553 k( 146) = ( 0.0781250 0.5000000 -0.0000000), wk = 0.0042553 k( 147) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0042553 k( 148) = ( 0.0468750 0.5000000 -0.0000000), wk = 0.0042553 k( 149) = ( 0.0312500 0.5000000 -0.0000000), wk = 0.0042553 k( 150) = ( 0.0156250 0.5000000 -0.0000000), wk = 0.0042553 k( 151) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0042553 k( 152) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0042553 k( 153) = ( 0.0000000 0.5073367 0.0285697), wk = 0.0042553 k( 154) = ( 0.0000000 0.5146734 0.0571393), wk = 0.0042553 k( 155) = ( 0.0000000 0.5220101 0.0857090), wk = 0.0042553 k( 156) = ( 0.5000000 0.4779899 0.9142910), wk = 0.0042553 k( 157) = ( 0.5000000 0.4602866 0.8989469), wk = 0.0042553 k( 158) = ( 0.5000000 0.4425833 0.8836028), wk = 0.0042553 k( 159) = ( 0.5000000 0.4248799 0.8682586), wk = 0.0042553 k( 160) = ( 0.5000000 0.4071766 0.8529145), wk = 0.0042553 k( 161) = ( 0.5000000 0.3894733 0.8375704), wk = 0.0042553 k( 162) = ( 0.5000000 0.3717699 0.8222263), wk = 0.0042553 k( 163) = ( 0.5000000 0.3540666 0.8068822), wk = 0.0042553 k( 164) = ( 0.5000000 0.3363633 0.7915381), wk = 0.0042553 k( 165) = ( 0.5000000 0.3186599 0.7761940), wk = 0.0042553 k( 166) = ( 0.5000000 0.3009566 0.7608499), wk = 0.0042553 k( 167) = ( 0.5000000 0.2832533 0.7455058), wk = 0.0042553 k( 168) = ( 0.5000000 0.2655500 0.7301617), wk = 0.0042553 k( 169) = ( 0.5000000 0.2478466 0.7148175), wk = 0.0042553 k( 170) = ( 0.5000000 0.2301433 0.6994734), wk = 0.0042553 k( 171) = ( 0.5000000 0.2124400 0.6841293), wk = 0.0042553 k( 172) = ( 0.5000000 0.1947366 0.6687852), wk = 0.0042553 k( 173) = ( 0.5000000 0.1770333 0.6534411), wk = 0.0042553 k( 174) = ( 0.5000000 0.1593300 0.6380970), wk = 0.0042553 k( 175) = ( 0.5000000 0.1416266 0.6227529), wk = 0.0042553 k( 176) = ( 0.5000000 0.1239233 0.6074088), wk = 0.0042553 k( 177) = ( 0.5000000 0.1062200 0.5920647), wk = 0.0042553 k( 178) = ( 0.5000000 0.0885166 0.5767205), wk = 0.0042553 k( 179) = ( 0.5000000 0.0708133 0.5613764), wk = 0.0042553 k( 180) = ( 0.5000000 0.0531100 0.5460323), wk = 0.0042553 k( 181) = ( 0.5000000 0.0354067 0.5306882), wk = 0.0042553 k( 182) = ( 0.5000000 0.0177033 0.5153441), wk = 0.0042553 k( 183) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0042553 k( 184) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0042553 k( 185) = ( 0.5000000 0.0000000 0.4722222), wk = 0.0042553 k( 186) = ( 0.5000000 0.0000000 0.4444444), wk = 0.0042553 k( 187) = ( 0.5000000 0.0000000 0.4166667), wk = 0.0042553 k( 188) = ( 0.5000000 0.0000000 0.3888889), wk = 0.0042553 k( 189) = ( 0.5000000 0.0000000 0.3611111), wk = 0.0042553 k( 190) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0042553 k( 191) = ( 0.5000000 0.0000000 0.3055556), wk = 0.0042553 k( 192) = ( 0.5000000 0.0000000 0.2777778), wk = 0.0042553 k( 193) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0042553 k( 194) = ( 0.5000000 0.0000000 0.2222222), wk = 0.0042553 k( 195) = ( 0.5000000 0.0000000 0.1944444), wk = 0.0042553 k( 196) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0042553 k( 197) = ( 0.5000000 0.0000000 0.1388889), wk = 0.0042553 k( 198) = ( 0.5000000 0.0000000 0.1111111), wk = 0.0042553 k( 199) = ( 0.5000000 0.0000000 0.0833333), wk = 0.0042553 k( 200) = ( 0.5000000 0.0000000 0.0555556), wk = 0.0042553 k( 201) = ( 0.5000000 0.0000000 0.0277778), wk = 0.0042553 k( 202) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0042553 k( 203) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0042553 k( 204) = ( 0.0156250 0.0000000 0.5000000), wk = 0.0042553 k( 205) = ( 0.0312500 0.0000000 0.5000000), wk = 0.0042553 k( 206) = ( 0.0468750 0.0000000 0.5000000), wk = 0.0042553 k( 207) = ( 0.0625000 0.0000000 0.5000000), wk = 0.0042553 k( 208) = ( 0.0781250 -0.0000000 0.5000000), wk = 0.0042553 k( 209) = ( 0.0937500 0.0000000 0.5000000), wk = 0.0042553 k( 210) = ( 0.1093750 0.0000000 0.5000000), wk = 0.0042553 k( 211) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0042553 k( 212) = ( 0.1406250 0.0000000 0.5000000), wk = 0.0042553 k( 213) = ( 0.1562500 -0.0000000 0.5000000), wk = 0.0042553 k( 214) = ( 0.1718750 0.0000000 0.5000000), wk = 0.0042553 k( 215) = ( 0.1875000 0.0000000 0.5000000), wk = 0.0042553 k( 216) = ( 0.2031250 0.0000000 0.5000000), wk = 0.0042553 k( 217) = ( 0.2187500 0.0000000 0.5000000), wk = 0.0042553 k( 218) = ( 0.2343750 0.0000000 0.5000000), wk = 0.0042553 k( 219) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0042553 k( 220) = ( 0.2656250 0.0000000 0.5000000), wk = 0.0042553 k( 221) = ( 0.2812500 0.0000000 0.5000000), wk = 0.0042553 k( 222) = ( 0.2968750 0.0000000 0.5000000), wk = 0.0042553 k( 223) = ( 0.3125000 -0.0000000 0.5000000), wk = 0.0042553 k( 224) = ( 0.3281250 0.0000000 0.5000000), wk = 0.0042553 k( 225) = ( 0.3437500 0.0000000 0.5000000), wk = 0.0042553 k( 226) = ( 0.3593750 0.0000000 0.5000000), wk = 0.0042553 k( 227) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0042553 k( 228) = ( 0.3906250 0.0000000 0.5000000), wk = 0.0042553 k( 229) = ( 0.4062500 0.0000000 0.5000000), wk = 0.0042553 k( 230) = ( 0.4218750 0.0000000 0.5000000), wk = 0.0042553 k( 231) = ( 0.4375000 0.0000000 0.5000000), wk = 0.0042553 k( 232) = ( 0.4531250 0.0000000 0.5000000), wk = 0.0042553 k( 233) = ( 0.4687500 0.0000000 0.5000000), wk = 0.0042553 k( 234) = ( 0.4843750 0.0000000 0.5000000), wk = 0.0042553 k( 235) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0042553 Dense grid: 237627 G-vectors FFT dimensions: ( 64, 72, 125) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.95 Mb ( 818, 76) NL pseudopotentials 2.40 Mb ( 409, 384) Each V/rho on FFT grid 0.14 Mb ( 9216) Each G-vector array 0.03 Mb ( 3300) G-vector shells 0.02 Mb ( 3245) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 3.79 Mb ( 818, 304) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.89 Mb ( 384, 2, 76) The potential is recalculated from file : ./LiP.save/charge-density.dat Starting wfc are 144 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.7 secs Computing kpt #: 2 total cpu time spent up to now is 7.3 secs Computing kpt #: 3 total cpu time spent up to now is 9.8 secs Computing kpt #: 4 total cpu time spent up to now is 12.3 secs Computing kpt #: 5 total cpu time spent up to now is 14.9 secs Computing kpt #: 6 total cpu time spent up to now is 17.3 secs Computing kpt #: 7 total cpu time spent up to now is 19.8 secs Computing kpt #: 8 total cpu time spent up to now is 22.3 secs Computing kpt #: 9 total cpu time spent up to now is 24.7 secs Computing kpt #: 10 total cpu time spent up to now is 27.1 secs Computing kpt #: 11 total cpu time spent up to now is 29.5 secs Computing kpt #: 12 total cpu time spent up to now is 31.8 secs Computing kpt #: 13 total cpu time spent up to now is 34.2 secs Computing kpt #: 14 total cpu time spent up to now is 36.6 secs Computing kpt #: 15 total cpu time spent up to now is 38.9 secs Computing kpt #: 16 total cpu time spent up to now is 41.2 secs Computing kpt #: 17 total cpu time spent up to now is 43.5 secs Computing kpt #: 18 total cpu time spent up to now is 45.8 secs Computing kpt #: 19 total cpu time spent up to now is 48.2 secs Computing kpt #: 20 total cpu time spent up to now is 50.5 secs Computing kpt #: 21 total cpu time spent up to now is 52.8 secs Computing kpt #: 22 total cpu time spent up to now is 55.2 secs Computing kpt #: 23 total cpu time spent up to now is 57.5 secs Computing kpt #: 24 total cpu time spent up to now is 59.9 secs Computing kpt #: 25 total cpu time spent up to now is 62.2 secs Computing kpt #: 26 total cpu time spent up to now is 64.6 secs Computing kpt #: 27 total cpu time spent up to now is 66.9 secs Computing kpt #: 28 total cpu time spent up to now is 69.5 secs Computing kpt #: 29 total cpu time spent up to now is 71.9 secs Computing kpt #: 30 total cpu time spent up to now is 74.3 secs Computing kpt #: 31 total cpu time spent up to now is 76.7 secs Computing kpt #: 32 total cpu time spent up to now is 79.1 secs Computing kpt #: 33 total cpu time spent up to now is 81.5 secs Computing kpt #: 34 total cpu time spent up to now is 83.9 secs Computing kpt #: 35 total cpu time spent up to now is 86.4 secs Computing kpt #: 36 total cpu time spent up to now is 88.8 secs Computing kpt #: 37 total cpu time spent up to now is 91.3 secs Computing kpt #: 38 total cpu time spent up to now is 93.7 secs Computing kpt #: 39 total cpu time spent up to now is 96.2 secs Computing kpt #: 40 total cpu time spent up to now is 98.8 secs Computing kpt #: 41 total cpu time spent up to now is 101.3 secs Computing kpt #: 42 total cpu time spent up to now is 103.9 secs Computing kpt #: 43 total cpu time spent up to now is 106.4 secs Computing kpt #: 44 total cpu time spent up to now is 109.2 secs Computing kpt #: 45 total cpu time spent up to now is 112.3 secs Computing kpt #: 46 total cpu time spent up to now is 114.9 secs Computing kpt #: 47 total cpu time spent up to now is 117.4 secs Computing kpt #: 48 total cpu time spent up to now is 120.0 secs Computing kpt #: 49 total cpu time spent up to now is 122.6 secs Computing kpt #: 50 total cpu time spent up to now is 125.2 secs Computing kpt #: 51 total cpu time spent up to now is 127.8 secs Computing kpt #: 52 total cpu time spent up to now is 130.3 secs Computing kpt #: 53 total cpu time spent up to now is 132.9 secs Computing kpt #: 54 total cpu time spent up to now is 135.5 secs Computing kpt #: 55 total cpu time spent up to now is 138.0 secs Computing kpt #: 56 total cpu time spent up to now is 140.5 secs Computing kpt #: 57 total cpu time spent up to now is 143.1 secs Computing kpt #: 58 total cpu time spent up to now is 145.6 secs Computing kpt #: 59 total cpu time spent up to now is 148.1 secs Computing kpt #: 60 total cpu time spent up to now is 150.7 secs Computing kpt #: 61 total cpu time spent up to now is 153.2 secs Computing kpt #: 62 total cpu time spent up to now is 155.7 secs Computing kpt #: 63 total cpu time spent up to now is 158.2 secs Computing kpt #: 64 total cpu time spent up to now is 160.8 secs Computing kpt #: 65 total cpu time spent up to now is 163.3 secs Computing kpt #: 66 total cpu time spent up to now is 165.8 secs Computing kpt #: 67 total cpu time spent up to now is 168.3 secs Computing kpt #: 68 total cpu time spent up to now is 170.9 secs Computing kpt #: 69 total cpu time spent up to now is 173.4 secs Computing kpt #: 70 total cpu time spent up to now is 175.9 secs Computing kpt #: 71 total cpu time spent up to now is 178.5 secs Computing kpt #: 72 total cpu time spent up to now is 181.0 secs Computing kpt #: 73 total cpu time spent up to now is 183.5 secs Computing kpt #: 74 total cpu time spent up to now is 186.0 secs Computing kpt #: 75 total cpu time spent up to now is 188.5 secs Computing kpt #: 76 total cpu time spent up to now is 191.1 secs Computing kpt #: 77 total cpu time spent up to now is 193.7 secs Computing kpt #: 78 total cpu time spent up to now is 196.2 secs Computing kpt #: 79 total cpu time spent up to now is 198.7 secs Computing kpt #: 80 total cpu time spent up to now is 201.3 secs Computing kpt #: 81 total cpu time spent up to now is 203.8 secs Computing kpt #: 82 total cpu time spent up to now is 206.4 secs Computing kpt #: 83 total cpu time spent up to now is 208.9 secs Computing kpt #: 84 total cpu time spent up to now is 211.4 secs Computing kpt #: 85 total cpu time spent up to now is 214.0 secs Computing kpt #: 86 total cpu time spent up to now is 216.5 secs Computing kpt #: 87 total cpu time spent up to now is 219.0 secs Computing kpt #: 88 total cpu time spent up to now is 221.5 secs Computing kpt #: 89 total cpu time spent up to now is 224.1 secs Computing kpt #: 90 total cpu time spent up to now is 227.0 secs Computing kpt #: 91 total cpu time spent up to now is 229.9 secs Computing kpt #: 92 total cpu time spent up to now is 232.4 secs Computing kpt #: 93 total cpu time spent up to now is 235.3 secs Computing kpt #: 94 total cpu time spent up to now is 238.2 secs Computing kpt #: 95 total cpu time spent up to now is 241.1 secs Computing kpt #: 96 total cpu time spent up to now is 244.1 secs Computing kpt #: 97 total cpu time spent up to now is 246.6 secs Computing kpt #: 98 total cpu time spent up to now is 249.2 secs Computing kpt #: 99 total cpu time spent up to now is 252.2 secs Computing kpt #: 100 total cpu time spent up to now is 255.9 secs Computing kpt #: 101 total cpu time spent up to now is 258.9 secs Computing kpt #: 102 total cpu time spent up to now is 262.2 secs Computing kpt #: 103 total cpu time spent up to now is 265.2 secs Computing kpt #: 104 total cpu time spent up to now is 268.3 secs Computing kpt #: 105 total cpu time spent up to now is 271.3 secs Computing kpt #: 106 total cpu time spent up to now is 274.6 secs Computing kpt #: 107 total cpu time spent up to now is 277.7 secs Computing kpt #: 108 total cpu time spent up to now is 280.7 secs Computing kpt #: 109 total cpu time spent up to now is 283.8 secs Computing kpt #: 110 total cpu time spent up to now is 286.8 secs Computing kpt #: 111 total cpu time spent up to now is 289.7 secs Computing kpt #: 112 total cpu time spent up to now is 292.7 secs Computing kpt #: 113 total cpu time spent up to now is 295.7 secs Computing kpt #: 114 total cpu time spent up to now is 298.7 secs Computing kpt #: 115 total cpu time spent up to now is 301.7 secs Computing kpt #: 116 total cpu time spent up to now is 304.6 secs Computing kpt #: 117 total cpu time spent up to now is 307.6 secs Computing kpt #: 118 total cpu time spent up to now is 310.5 secs Computing kpt #: 119 total cpu time spent up to now is 313.5 secs Computing kpt #: 120 total cpu time spent up to now is 316.4 secs Computing kpt #: 121 total cpu time spent up to now is 319.5 secs Computing kpt #: 122 total cpu time spent up to now is 322.5 secs Computing kpt #: 123 total cpu time spent up to now is 325.5 secs Computing kpt #: 124 total cpu time spent up to now is 328.6 secs Computing kpt #: 125 total cpu time spent up to now is 331.7 secs Computing kpt #: 126 total cpu time spent up to now is 336.1 secs Computing kpt #: 127 total cpu time spent up to now is 339.0 secs Computing kpt #: 128 total cpu time spent up to now is 341.6 secs Computing kpt #: 129 total cpu time spent up to now is 344.5 secs Computing kpt #: 130 total cpu time spent up to now is 347.4 secs Computing kpt #: 131 total cpu time spent up to now is 350.3 secs Computing kpt #: 132 total cpu time spent up to now is 353.2 secs Computing kpt #: 133 total cpu time spent up to now is 356.1 secs Computing kpt #: 134 total cpu time spent up to now is 358.7 secs Computing kpt #: 135 total cpu time spent up to now is 361.2 secs Computing kpt #: 136 total cpu time spent up to now is 363.7 secs Computing kpt #: 137 total cpu time spent up to now is 366.3 secs Computing kpt #: 138 total cpu time spent up to now is 368.9 secs Computing kpt #: 139 total cpu time spent up to now is 371.6 secs Computing kpt #: 140 total cpu time spent up to now is 374.2 secs Computing kpt #: 141 total cpu time spent up to now is 376.8 secs Computing kpt #: 142 total cpu time spent up to now is 379.3 secs Computing kpt #: 143 total cpu time spent up to now is 381.9 secs Computing kpt #: 144 total cpu time spent up to now is 384.6 secs Computing kpt #: 145 total cpu time spent up to now is 387.2 secs Computing kpt #: 146 total cpu time spent up to now is 390.1 secs Computing kpt #: 147 total cpu time spent up to now is 393.1 secs Computing kpt #: 148 total cpu time spent up to now is 396.0 secs Computing kpt #: 149 total cpu time spent up to now is 399.0 secs Computing kpt #: 150 total cpu time spent up to now is 402.0 secs Computing kpt #: 151 total cpu time spent up to now is 404.9 secs Computing kpt #: 152 total cpu time spent up to now is 407.9 secs Computing kpt #: 153 total cpu time spent up to now is 411.2 secs Computing kpt #: 154 total cpu time spent up to now is 414.2 secs Computing kpt #: 155 total cpu time spent up to now is 417.1 secs Computing kpt #: 156 total cpu time spent up to now is 420.0 secs Computing kpt #: 157 total cpu time spent up to now is 423.0 secs Computing kpt #: 158 total cpu time spent up to now is 425.9 secs Computing kpt #: 159 total cpu time spent up to now is 428.9 secs Computing kpt #: 160 total cpu time spent up to now is 431.9 secs Computing kpt #: 161 total cpu time spent up to now is 434.8 secs Computing kpt #: 162 total cpu time spent up to now is 437.7 secs Computing kpt #: 163 total cpu time spent up to now is 440.6 secs Computing kpt #: 164 total cpu time spent up to now is 443.5 secs Computing kpt #: 165 total cpu time spent up to now is 446.4 secs Computing kpt #: 166 total cpu time spent up to now is 449.3 secs Computing kpt #: 167 total cpu time spent up to now is 451.9 secs Computing kpt #: 168 total cpu time spent up to now is 454.4 secs Computing kpt #: 169 total cpu time spent up to now is 456.9 secs Computing kpt #: 170 total cpu time spent up to now is 459.4 secs Computing kpt #: 171 total cpu time spent up to now is 461.9 secs Computing kpt #: 172 total cpu time spent up to now is 464.4 secs Computing kpt #: 173 total cpu time spent up to now is 466.9 secs Computing kpt #: 174 total cpu time spent up to now is 469.4 secs Computing kpt #: 175 total cpu time spent up to now is 471.9 secs Computing kpt #: 176 total cpu time spent up to now is 474.4 secs Computing kpt #: 177 total cpu time spent up to now is 476.8 secs Computing kpt #: 178 total cpu time spent up to now is 479.3 secs Computing kpt #: 179 total cpu time spent up to now is 481.8 secs Computing kpt #: 180 total cpu time spent up to now is 484.3 secs Computing kpt #: 181 total cpu time spent up to now is 486.7 secs Computing kpt #: 182 total cpu time spent up to now is 489.2 secs Computing kpt #: 183 total cpu time spent up to now is 491.7 secs Computing kpt #: 184 total cpu time spent up to now is 494.2 secs Computing kpt #: 185 total cpu time spent up to now is 496.7 secs Computing kpt #: 186 total cpu time spent up to now is 499.1 secs Computing kpt #: 187 total cpu time spent up to now is 501.6 secs Computing kpt #: 188 total cpu time spent up to now is 504.1 secs Computing kpt #: 189 total cpu time spent up to now is 506.6 secs Computing kpt #: 190 total cpu time spent up to now is 509.1 secs Computing kpt #: 191 total cpu time spent up to now is 511.6 secs Computing kpt #: 192 total cpu time spent up to now is 514.1 secs Computing kpt #: 193 total cpu time spent up to now is 516.6 secs Computing kpt #: 194 total cpu time spent up to now is 519.2 secs Computing kpt #: 195 total cpu time spent up to now is 521.7 secs Computing kpt #: 196 total cpu time spent up to now is 524.2 secs Computing kpt #: 197 total cpu time spent up to now is 526.7 secs Computing kpt #: 198 total cpu time spent up to now is 529.3 secs Computing kpt #: 199 total cpu time spent up to now is 531.8 secs Computing kpt #: 200 total cpu time spent up to now is 534.3 secs Computing kpt #: 201 total cpu time spent up to now is 536.9 secs Computing kpt #: 202 total cpu time spent up to now is 539.4 secs Computing kpt #: 203 total cpu time spent up to now is 541.8 secs Computing kpt #: 204 total cpu time spent up to now is 544.1 secs Computing kpt #: 205 total cpu time spent up to now is 546.4 secs Computing kpt #: 206 total cpu time spent up to now is 548.8 secs Computing kpt #: 207 total cpu time spent up to now is 551.2 secs Computing kpt #: 208 total cpu time spent up to now is 553.5 secs Computing kpt #: 209 total cpu time spent up to now is 555.9 secs Computing kpt #: 210 total cpu time spent up to now is 558.3 secs Computing kpt #: 211 total cpu time spent up to now is 560.6 secs Computing kpt #: 212 total cpu time spent up to now is 563.0 secs Computing kpt #: 213 total cpu time spent up to now is 565.5 secs Computing kpt #: 214 total cpu time spent up to now is 567.9 secs Computing kpt #: 215 total cpu time spent up to now is 570.4 secs Computing kpt #: 216 total cpu time spent up to now is 572.8 secs Computing kpt #: 217 total cpu time spent up to now is 575.3 secs Computing kpt #: 218 total cpu time spent up to now is 577.8 secs Computing kpt #: 219 total cpu time spent up to now is 580.3 secs Computing kpt #: 220 total cpu time spent up to now is 582.9 secs Computing kpt #: 221 total cpu time spent up to now is 585.4 secs Computing kpt #: 222 total cpu time spent up to now is 587.9 secs Computing kpt #: 223 total cpu time spent up to now is 590.4 secs Computing kpt #: 224 total cpu time spent up to now is 592.9 secs Computing kpt #: 225 total cpu time spent up to now is 595.4 secs Computing kpt #: 226 total cpu time spent up to now is 598.0 secs Computing kpt #: 227 total cpu time spent up to now is 600.5 secs Computing kpt #: 228 total cpu time spent up to now is 603.0 secs Computing kpt #: 229 total cpu time spent up to now is 605.5 secs Computing kpt #: 230 total cpu time spent up to now is 608.0 secs Computing kpt #: 231 total cpu time spent up to now is 610.5 secs Computing kpt #: 232 total cpu time spent up to now is 613.0 secs Computing kpt #: 233 total cpu time spent up to now is 615.5 secs Computing kpt #: 234 total cpu time spent up to now is 618.0 secs Computing kpt #: 235 total cpu time spent up to now is 620.4 secs ethr = 1.56E-08, avg # of iterations = 19.3 total cpu time spent up to now is 620.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 29683 PWs) bands (ev): -40.6992 -40.6992 -40.6981 -40.6981 -40.6895 -40.6895 -40.6887 -40.6887 -40.6677 -40.6677 -40.6670 -40.6670 -40.6649 -40.6649 -40.6649 -40.6649 -8.1640 -8.1640 -7.8848 -7.8848 -5.5288 -5.5288 -5.1614 -5.1614 -5.0151 -5.0151 -4.8901 -4.8901 -1.3985 -1.3985 -1.1695 -1.1695 -0.1486 -0.1486 0.4719 0.4719 0.6824 0.6824 0.7434 0.7434 1.4366 1.4366 1.7610 1.7610 1.9438 1.9438 2.2215 2.2215 2.7728 2.7728 3.2609 3.2609 3.3991 3.3991 3.6956 3.6956 4.1353 4.1353 4.2480 4.2480 4.3935 4.3935 5.2207 5.2207 6.3327 6.3327 6.6074 6.6074 7.0046 7.0046 7.1353 7.1353 7.4855 7.4855 8.2866 8.2866 k = 0.0000 0.0000 0.0152 ( 29673 PWs) bands (ev): -40.6992 -40.6992 -40.6981 -40.6981 -40.6895 -40.6895 -40.6887 -40.6887 -40.6677 -40.6677 -40.6670 -40.6670 -40.6649 -40.6649 -40.6649 -40.6649 -8.1636 -8.1636 -7.8855 -7.8855 -5.5277 -5.5277 -5.1610 -5.1610 -5.0159 -5.0159 -4.8908 -4.8908 -1.3978 -1.3978 -1.1694 -1.1694 -0.1485 -0.1485 0.4702 0.4702 0.6820 0.6820 0.7429 0.7429 1.4373 1.4373 1.7606 1.7606 1.9451 1.9451 2.2214 2.2214 2.7730 2.7730 3.2639 3.2639 3.3948 3.3948 3.6988 3.6988 4.1331 4.1331 4.2511 4.2511 4.3921 4.3921 5.2186 5.2186 6.3358 6.3358 6.6074 6.6074 6.9996 6.9996 7.1362 7.1362 7.4893 7.4893 8.2434 8.2434 k = 0.0000 0.0000 0.0304 ( 29681 PWs) bands (ev): -40.6992 -40.6992 -40.6981 -40.6981 -40.6895 -40.6895 -40.6887 -40.6887 -40.6677 -40.6677 -40.6671 -40.6671 -40.6649 -40.6649 -40.6649 -40.6649 -8.1622 -8.1622 -7.8874 -7.8874 -5.5244 -5.5244 -5.1597 -5.1597 -5.0183 -5.0183 -4.8929 -4.8929 -1.3959 -1.3959 -1.1688 -1.1688 -0.1481 -0.1481 0.4649 0.4649 0.6810 0.6810 0.7416 0.7416 1.4394 1.4394 1.7591 1.7591 1.9491 1.9491 2.2213 2.2213 2.7734 2.7734 3.2726 3.2726 3.3826 3.3826 3.7079 3.7079 4.1271 4.1271 4.2597 4.2597 4.3882 4.3882 5.2126 5.2126 6.3451 6.3451 6.6074 6.6074 6.9855 6.9855 7.1387 7.1387 7.4995 7.4995 8.1898 8.1898 k = 0.0000 0.0000 0.0455 ( 29685 PWs) bands (ev): -40.6992 -40.6992 -40.6981 -40.6981 -40.6895 -40.6895 -40.6887 -40.6887 -40.6677 -40.6677 -40.6671 -40.6671 -40.6649 -40.6649 -40.6649 -40.6649 -8.1600 -8.1600 -7.8905 -7.8905 -5.5190 -5.5190 -5.1576 -5.1576 -5.0223 -5.0223 -4.8963 -4.8963 -1.3927 -1.3927 -1.1680 -1.1680 -0.1474 -0.1474 0.4563 0.4563 0.6794 0.6794 0.7393 0.7393 1.4429 1.4429 1.7566 1.7566 1.9555 1.9555 2.2210 2.2210 2.7745 2.7745 3.2869 3.2869 3.3642 3.3642 3.7212 3.7212 4.1186 4.1186 4.2725 4.2725 4.3814 4.3814 5.2031 5.2031 6.3601 6.3601 6.6075 6.6075 6.9646 6.9646 7.1429 7.1429 7.5135 7.5135 8.1353 8.1353 k = 0.0000 0.0000 0.0607 ( 29679 PWs) bands (ev): -40.6992 -40.6992 -40.6981 -40.6981 -40.6895 -40.6895 -40.6887 -40.6887 -40.6677 -40.6677 -40.6671 -40.6671 -40.6649 -40.6649 -40.6649 -40.6649 -8.1568 -8.1568 -7.8948 -7.8948 -5.5114 -5.5114 -5.1546 -5.1546 -5.0279 -5.0279 -4.9010 -4.9010 -1.3883 -1.3883 -1.1671 -1.1671 -0.1462 -0.1462 0.4443 0.4443 0.6772 0.6772 0.7362 0.7362 1.4477 1.4477 1.7531 1.7531 1.9644 1.9644 2.2205 2.2205 2.7763 2.7763 3.3062 3.3062 3.3413 3.3413 3.7369 3.7369 4.1088 4.1088 4.2886 4.2886 4.3716 4.3716 5.1907 5.1907 6.3800 6.3800 6.6079 6.6079 6.9398 6.9398 7.1484 7.1484 7.5280 7.5280 8.0800 8.0800 k = 0.0000 0.0000 0.0759 ( 29681 PWs) bands (ev): -40.6992 -40.6992 -40.6981 -40.6981 -40.6895 -40.6895 -40.6887 -40.6887 -40.6677 -40.6677 -40.6671 -40.6671 -40.6649 -40.6649 -40.6649 -40.6649 -8.1528 -8.1528 -7.9003 -7.9003 -5.5018 -5.5018 -5.1508 -5.1508 -5.0351 -5.0351 -4.9069 -4.9069 -1.3826 -1.3826 -1.1662 -1.1662 -0.1442 -0.1442 0.4292 0.4292 0.6746 0.6746 0.7323 0.7323 1.4538 1.4538 1.7485 1.7485 1.9754 1.9754 2.2200 2.2200 2.7794 2.7794 3.3153 3.3153 3.3301 3.3301 3.7535 3.7535 4.0984 4.0984 4.3070 4.3070 4.3588 4.3588 5.1759 5.1759 6.4040 6.4040 6.6086 6.6086 6.9136 6.9136 7.1551 7.1551 7.5401 7.5401 8.0238 8.0238 k = 0.0000 0.0000 0.0911 ( 29670 PWs) bands (ev): -40.6992 -40.6992 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6677 -40.6677 -40.6671 -40.6671 -40.6649 -40.6649 -40.6649 -40.6649 -8.1479 -8.1479 -7.9069 -7.9069 -5.4903 -5.4903 -5.1462 -5.1462 -5.0439 -5.0439 -4.9139 -4.9139 -1.3758 -1.3758 -1.1656 -1.1656 -0.1411 -0.1411 0.4110 0.4110 0.6718 0.6718 0.7277 0.7277 1.4609 1.4609 1.7427 1.7427 1.9884 1.9884 2.2194 2.2194 2.7838 2.7838 3.2880 3.2880 3.3574 3.3574 3.7697 3.7697 4.0879 4.0879 4.3248 4.3248 4.3454 4.3454 5.1592 5.1592 6.4314 6.4314 6.6099 6.6099 6.8881 6.8881 7.1626 7.1626 7.5479 7.5479 7.9664 7.9664 k = 0.0000 0.0000 0.1062 ( 29663 PWs) bands (ev): -40.6992 -40.6992 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6677 -40.6677 -40.6671 -40.6671 -40.6649 -40.6649 -40.6649 -40.6649 -8.1422 -8.1422 -7.9144 -7.9144 -5.4770 -5.4770 -5.1409 -5.1409 -5.0543 -5.0543 -4.9219 -4.9219 -1.3679 -1.3679 -1.1654 -1.1654 -0.1365 -0.1365 0.3902 0.3902 0.6688 0.6688 0.7225 0.7225 1.4690 1.4690 1.7357 1.7357 2.0029 2.0029 2.2186 2.2186 2.7899 2.7899 3.2596 3.2596 3.3880 3.3880 3.7849 3.7849 4.0778 4.0778 4.3174 4.3174 4.3559 4.3559 5.1408 5.1408 6.4614 6.4614 6.6120 6.6120 6.8647 6.8647 7.1705 7.1705 7.5504 7.5504 7.9079 7.9079 k = 0.0000 0.0000 0.1214 ( 29663 PWs) bands (ev): -40.6992 -40.6992 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6677 -40.6677 -40.6671 -40.6671 -40.6649 -40.6649 -40.6649 -40.6649 -8.1357 -8.1357 -7.9229 -7.9229 -5.4620 -5.4620 -5.1348 -5.1348 -5.0662 -5.0662 -4.9308 -4.9308 -1.3589 -1.3589 -1.1659 -1.1659 -0.1303 -0.1303 0.3667 0.3667 0.6658 0.6658 0.7168 0.7168 1.4781 1.4781 1.7277 1.7277 2.0187 2.0187 2.2176 2.2176 2.7979 2.7979 3.2310 3.2310 3.4210 3.4210 3.7986 3.7986 4.0682 4.0682 4.2946 4.2946 4.3806 4.3806 5.1205 5.1205 6.4936 6.4936 6.6149 6.6149 6.8446 6.8446 7.1784 7.1784 7.5475 7.5475 7.8484 7.8484 k = 0.0000 0.0000 0.1366 ( 29666 PWs) bands (ev): -40.6992 -40.6992 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6676 -40.6676 -40.6671 -40.6671 -40.6649 -40.6649 -40.6649 -40.6649 -8.1285 -8.1285 -7.9322 -7.9322 -5.4454 -5.4454 -5.1279 -5.1279 -5.0797 -5.0797 -4.9403 -4.9403 -1.3490 -1.3490 -1.1674 -1.1674 -0.1220 -0.1220 0.3410 0.3410 0.6630 0.6630 0.7108 0.7108 1.4881 1.4881 1.7184 1.7184 2.0353 2.0353 2.2164 2.2164 2.8078 2.8078 3.2024 3.2024 3.4559 3.4559 3.8103 3.8103 4.0592 4.0592 4.2679 4.2679 4.4087 4.4087 5.0982 5.0982 6.5275 6.5275 6.6189 6.6189 6.8283 6.8283 7.1856 7.1856 7.5402 7.5402 7.7881 7.7881 k = 0.0000 0.0000 0.1518 ( 29660 PWs) bands (ev): -40.6991 -40.6991 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6676 -40.6676 -40.6672 -40.6672 -40.6649 -40.6649 -40.6648 -40.6648 -8.1205 -8.1205 -7.9422 -7.9422 -5.4274 -5.4274 -5.1204 -5.1204 -5.0946 -5.0946 -4.9505 -4.9505 -1.3382 -1.3382 -1.1699 -1.1699 -0.1115 -0.1115 0.3134 0.3134 0.6605 0.6605 0.7046 0.7046 1.4987 1.4987 1.7082 1.7082 2.0526 2.0526 2.2148 2.2148 2.8195 2.8195 3.1741 3.1741 3.4920 3.4920 3.8198 3.8198 4.0510 4.0510 4.2385 4.2385 4.4396 4.4396 5.0733 5.0733 6.5628 6.5628 6.6240 6.6240 6.8161 6.8161 7.1915 7.1915 7.5294 7.5294 7.7278 7.7278 k = 0.0000 0.0000 0.1669 ( 29671 PWs) bands (ev): -40.6991 -40.6991 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6676 -40.6676 -40.6672 -40.6672 -40.6649 -40.6649 -40.6649 -40.6649 -8.1118 -8.1118 -7.9529 -7.9529 -5.4082 -5.4082 -5.1123 -5.1123 -5.1109 -5.1109 -4.9612 -4.9612 -1.3266 -1.3266 -1.1738 -1.1738 -0.0984 -0.0984 0.2841 0.2841 0.6584 0.6584 0.6982 0.6982 1.5101 1.5101 1.6970 1.6970 2.0700 2.0700 2.2128 2.2128 2.8331 2.8331 3.1462 3.1462 3.5290 3.5290 3.8269 3.8269 4.0436 4.0436 4.2074 4.2074 4.4731 4.4731 5.0455 5.0455 6.5989 6.5989 6.6302 6.6302 6.8086 6.8086 7.1948 7.1948 7.5165 7.5165 7.6685 7.6685 k = 0.0000 0.0000 0.1821 ( 29686 PWs) bands (ev): -40.6991 -40.6991 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6676 -40.6676 -40.6672 -40.6672 -40.6649 -40.6649 -40.6649 -40.6649 -8.1024 -8.1024 -7.9641 -7.9641 -5.3880 -5.3880 -5.1286 -5.1286 -5.1035 -5.1035 -4.9723 -4.9723 -1.3144 -1.3144 -1.1789 -1.1789 -0.0828 -0.0828 0.2534 0.2534 0.6569 0.6569 0.6920 0.6920 1.5220 1.5220 1.6849 1.6849 2.0872 2.0872 2.2101 2.2101 2.8484 2.8484 3.1189 3.1189 3.5662 3.5662 3.8313 3.8313 4.0374 4.0374 4.1755 4.1755 4.5094 4.5094 5.0145 5.0145 6.6339 6.6339 6.6379 6.6379 6.8067 6.8067 7.1940 7.1940 7.5027 7.5027 7.6119 7.6119 k = 0.0000 0.0000 0.1973 ( 29685 PWs) bands (ev): -40.6991 -40.6991 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6675 -40.6675 -40.6672 -40.6672 -40.6649 -40.6649 -40.6649 -40.6649 -8.0925 -8.0925 -7.9756 -7.9756 -5.3668 -5.3668 -5.1474 -5.1474 -5.0942 -5.0942 -4.9836 -4.9836 -1.3017 -1.3017 -1.1855 -1.1855 -0.0645 -0.0645 0.2218 0.2218 0.6560 0.6560 0.6859 0.6859 1.5345 1.5345 1.6722 1.6722 2.1040 2.1040 2.2066 2.2066 2.8653 2.8653 3.0922 3.0922 3.6033 3.6033 3.8324 3.8324 4.0323 4.0323 4.1442 4.1442 4.5481 4.5481 4.9802 4.9802 6.6456 6.6456 6.6660 6.6660 6.8131 6.8131 7.1871 7.1871 7.4891 7.4891 7.5605 7.5605 k = 0.0000 0.0000 0.2125 ( 29698 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6675 -40.6675 -40.6673 -40.6673 -40.6649 -40.6649 -40.6649 -40.6649 -8.0820 -8.0820 -7.9875 -7.9875 -5.3450 -5.3450 -5.1673 -5.1673 -5.0844 -5.0844 -4.9952 -4.9952 -1.2886 -1.2886 -1.1934 -1.1934 -0.0436 -0.0436 0.1896 0.1896 0.6557 0.6557 0.6802 0.6802 1.5475 1.5475 1.6589 1.6589 2.1200 2.1200 2.2022 2.2022 2.8836 2.8836 3.0661 3.0661 3.6398 3.6398 3.8297 3.8297 4.0286 4.0286 4.1146 4.1146 4.5893 4.5893 4.9426 4.9426 6.6547 6.6547 6.6886 6.6886 6.8320 6.8320 7.1715 7.1715 7.4763 7.4763 7.5171 7.5171 k = 0.0000 0.0000 0.2276 ( 29693 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6675 -40.6675 -40.6673 -40.6673 -40.6649 -40.6649 -40.6649 -40.6649 -8.0711 -8.0711 -7.9996 -7.9996 -5.3226 -5.3226 -5.1881 -5.1881 -5.0742 -5.0742 -5.0068 -5.0068 -1.2754 -1.2754 -1.2026 -1.2026 -0.0202 -0.0202 0.1571 0.1571 0.6562 0.6562 0.6748 0.6748 1.5609 1.5609 1.6452 1.6452 2.1350 2.1350 2.1967 2.1967 2.9032 2.9032 3.0406 3.0406 3.6753 3.6753 3.8224 3.8224 4.0268 4.0268 4.0882 4.0882 4.6324 4.6324 4.9021 4.9021 6.6642 6.6642 6.6997 6.6997 6.8652 6.8652 7.1451 7.1451 7.4651 7.4651 7.4844 7.4844 k = 0.0000 0.0000 0.2428 ( 29691 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6673 -40.6673 -40.6649 -40.6649 -40.6649 -40.6649 -8.0597 -8.0597 -8.0118 -8.0118 -5.2999 -5.2999 -5.2096 -5.2096 -5.0636 -5.0636 -5.0184 -5.0184 -1.2621 -1.2621 -1.2129 -1.2129 0.0054 0.0054 0.1249 0.1249 0.6575 0.6575 0.6700 0.6700 1.5746 1.5746 1.6312 1.6312 2.1488 2.1488 2.1899 2.1899 2.9239 2.9239 3.0158 3.0158 3.7091 3.7091 3.8098 3.8098 4.0272 4.0272 4.0662 4.0662 4.6771 4.6771 4.8592 4.8592 6.6738 6.6738 6.7017 6.7017 6.9093 6.9093 7.1079 7.1079 7.4562 7.4562 7.4632 7.4632 k = 0.0000 0.0000 0.2580 ( 29676 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -8.0480 -8.0480 -8.0240 -8.0240 -5.2771 -5.2771 -5.2318 -5.2318 -5.0526 -5.0526 -5.0300 -5.0300 -1.2490 -1.2490 -1.2242 -1.2242 0.0331 0.0331 0.0932 0.0932 0.6595 0.6595 0.6658 0.6658 1.5886 1.5886 1.6170 1.6170 2.1612 2.1612 2.1818 2.1818 2.9456 2.9456 2.9917 2.9917 3.7404 3.7404 3.7917 3.7917 4.0305 4.0305 4.0493 4.0493 4.7228 4.7228 4.8146 4.8146 6.6832 6.6832 6.6982 6.6982 6.9594 6.9594 7.0623 7.0623 7.4502 7.4502 7.4520 7.4520 k = 0.0000 0.0000 0.2732 ( 29672 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -8.0361 -8.0361 -8.0360 -8.0360 -5.2544 -5.2544 -5.2543 -5.2543 -5.0414 -5.0414 -5.0413 -5.0413 -1.2363 -1.2363 -1.2363 -1.2363 0.0624 0.0624 0.0625 0.0625 0.6621 0.6621 0.6625 0.6625 1.6027 1.6027 1.6028 1.6028 2.1722 2.1722 2.1724 2.1724 2.9683 2.9683 2.9683 2.9683 3.7682 3.7682 3.7683 3.7683 4.0376 4.0376 4.0376 4.0376 4.7688 4.7688 4.7688 4.7688 6.6915 6.6915 6.6917 6.6917 7.0114 7.0114 7.0117 7.0117 7.4483 7.4483 7.4484 7.4484 k = 0.0000 0.0000 0.2732 ( 29672 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -8.0361 -8.0361 -8.0360 -8.0360 -5.2544 -5.2544 -5.2543 -5.2543 -5.0414 -5.0414 -5.0413 -5.0413 -1.2363 -1.2363 -1.2363 -1.2363 0.0624 0.0624 0.0625 0.0625 0.6621 0.6621 0.6625 0.6625 1.6027 1.6027 1.6028 1.6028 2.1722 2.1722 2.1724 2.1724 2.9683 2.9683 2.9683 2.9683 3.7682 3.7682 3.7683 3.7683 4.0376 4.0376 4.0376 4.0376 4.7688 4.7688 4.7688 4.7688 6.6915 6.6915 6.6917 6.6917 7.0114 7.0114 7.0117 7.0117 7.4483 7.4483 7.4484 7.4484 k = 0.0000 0.0157 0.2732 ( 29678 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -8.0364 -8.0364 -8.0353 -8.0353 -5.2561 -5.2561 -5.2537 -5.2537 -5.0446 -5.0446 -5.0384 -5.0384 -1.2458 -1.2458 -1.2261 -1.2261 0.0513 0.0513 0.0723 0.0723 0.6553 0.6553 0.6709 0.6709 1.5923 1.5923 1.6118 1.6118 2.1696 2.1696 2.1767 2.1767 2.9460 2.9460 2.9876 2.9876 3.7478 3.7478 3.7930 3.7930 4.0269 4.0269 4.0470 4.0470 4.7640 4.7640 4.7733 4.7733 6.6632 6.6632 6.7231 6.7231 7.0118 7.0118 7.0131 7.0131 7.4298 7.4298 7.4711 7.4711 k = 0.0000 0.0313 0.2732 ( 29677 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6648 -40.6648 -8.0362 -8.0362 -8.0340 -8.0340 -5.2590 -5.2590 -5.2542 -5.2542 -5.0480 -5.0480 -5.0358 -5.0358 -1.2547 -1.2547 -1.2150 -1.2150 0.0395 0.0395 0.0804 0.0804 0.6501 0.6501 0.6809 0.6809 1.5810 1.5810 1.6188 1.6188 2.1685 2.1685 2.1831 2.1831 2.9209 2.9209 3.0039 3.0039 3.7321 3.7321 3.8215 3.8215 4.0150 4.0150 4.0551 4.0551 4.7593 4.7593 4.7769 4.7769 6.6388 6.6388 6.7570 6.7570 7.0136 7.0136 7.0164 7.0164 7.4165 7.4165 7.4973 7.4973 k = 0.0000 0.0470 0.2732 ( 29675 PWs) bands (ev): -40.6990 -40.6990 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6648 -40.6648 -8.0355 -8.0355 -8.0322 -8.0322 -5.2632 -5.2632 -5.2558 -5.2558 -5.0515 -5.0515 -5.0335 -5.0335 -1.2632 -1.2632 -1.2028 -1.2028 0.0273 0.0273 0.0864 0.0864 0.6470 0.6470 0.6918 0.6918 1.5693 1.5693 1.6235 1.6235 2.1684 2.1684 2.1917 2.1917 2.8933 2.8933 3.0173 3.0173 3.7212 3.7212 3.8526 3.8526 4.0020 4.0020 4.0622 4.0622 4.7553 4.7553 4.7795 4.7795 6.6189 6.6189 6.7923 6.7923 7.0163 7.0163 7.0209 7.0209 7.4097 7.4097 7.5264 7.5264 k = 0.0000 0.0627 0.2732 ( 29671 PWs) bands (ev): -40.6990 -40.6990 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6648 -40.6648 -8.0342 -8.0342 -8.0299 -8.0299 -5.2686 -5.2686 -5.2584 -5.2584 -5.0549 -5.0549 -5.0315 -5.0315 -1.2715 -1.2715 -1.1896 -1.1896 0.0154 0.0154 0.0898 0.0898 0.6461 0.6461 0.7036 0.7036 1.5577 1.5577 1.6254 1.6254 2.1692 2.1692 2.2026 2.2026 2.8637 2.8637 3.0280 3.0280 3.7152 3.7152 3.8845 3.8845 3.9889 3.9889 4.0685 4.0685 4.7526 4.7526 4.7810 4.7810 6.6038 6.6038 6.8281 6.8281 7.0188 7.0188 7.0262 7.0262 7.4110 7.4110 7.5583 7.5583 k = 0.0000 0.0783 0.2732 ( 29680 PWs) bands (ev): -40.6990 -40.6990 -40.6982 -40.6982 -40.6896 -40.6896 -40.6888 -40.6888 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6648 -40.6648 -8.0325 -8.0325 -8.0271 -8.0271 -5.2754 -5.2754 -5.2621 -5.2621 -5.0581 -5.0581 -5.0298 -5.0298 -1.2799 -1.2799 -1.1752 -1.1752 0.0041 0.0041 0.0904 0.0904 0.6476 0.6476 0.7159 0.7159 1.5467 1.5467 1.6243 1.6243 2.1704 2.1704 2.2155 2.2155 2.8326 2.8326 3.0365 3.0365 3.7138 3.7138 3.9133 3.9133 3.9785 3.9785 4.0744 4.0744 4.7519 4.7519 4.7811 4.7811 6.5939 6.5939 6.8636 6.8636 7.0200 7.0200 7.0312 7.0312 7.4219 7.4219 7.5927 7.5927 k = 0.0000 0.0940 0.2732 ( 29674 PWs) bands (ev): -40.6990 -40.6990 -40.6982 -40.6982 -40.6896 -40.6896 -40.6888 -40.6888 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6648 -40.6648 -8.0303 -8.0303 -8.0240 -8.0240 -5.2836 -5.2836 -5.2668 -5.2668 -5.0609 -5.0609 -5.0284 -5.0284 -1.2884 -1.2884 -1.1596 -1.1596 -0.0060 -0.0060 0.0882 0.0882 0.6514 0.6514 0.7284 0.7284 1.5365 1.5365 1.6202 1.6202 2.1719 2.1719 2.2303 2.2303 2.8003 2.8003 3.0430 3.0430 3.7169 3.7169 3.9268 3.9268 3.9819 3.9819 4.0802 4.0802 4.7537 4.7537 4.7801 4.7801 6.5893 6.5893 6.8981 6.8981 7.0192 7.0192 7.0352 7.0352 7.4430 7.4430 7.6299 7.6299 k = 0.0000 0.1097 0.2732 ( 29665 PWs) bands (ev): -40.6989 -40.6989 -40.6981 -40.6981 -40.6896 -40.6896 -40.6888 -40.6888 -40.6674 -40.6674 -40.6673 -40.6673 -40.6649 -40.6649 -40.6648 -40.6648 -8.0276 -8.0276 -8.0205 -8.0205 -5.2931 -5.2931 -5.2726 -5.2726 -5.0633 -5.0633 -5.0272 -5.0272 -1.2974 -1.2974 -1.1428 -1.1428 -0.0147 -0.0147 0.0832 0.0832 0.6573 0.6573 0.7409 0.7409 1.5276 1.5276 1.6132 1.6132 2.1733 2.1733 2.2462 2.2462 2.7675 2.7675 3.0480 3.0480 3.7243 3.7243 3.9190 3.9190 4.0042 4.0042 4.0863 4.0863 4.7587 4.7587 4.7781 4.7781 6.5899 6.5899 6.9310 6.9310 7.0165 7.0165 7.0370 7.0370 7.4743 7.4743 7.6698 7.6698 k = 0.0000 0.1253 0.2732 ( 29678 PWs) bands (ev): -40.6989 -40.6989 -40.6981 -40.6981 -40.6897 -40.6897 -40.6889 -40.6889 -40.6675 -40.6675 -40.6673 -40.6673 -40.6649 -40.6649 -40.6648 -40.6648 -8.0245 -8.0245 -8.0166 -8.0166 -5.3040 -5.3040 -5.2794 -5.2794 -5.0651 -5.0651 -5.0261 -5.0261 -1.3069 -1.3069 -1.1249 -1.1249 -0.0217 -0.0217 0.0754 0.0754 0.6653 0.6653 0.7532 0.7532 1.5202 1.5202 1.6036 1.6036 2.1744 2.1744 2.2627 2.2627 2.7346 2.7346 3.0520 3.0520 3.7356 3.7356 3.9034 3.9034 4.0309 4.0309 4.0930 4.0930 4.7661 4.7661 4.7763 4.7763 6.5956 6.5956 6.9605 6.9605 7.0140 7.0140 7.0360 7.0360 7.5148 7.5148 7.7127 7.7127 k = 0.0000 0.1410 0.2732 ( 29676 PWs) bands (ev): -40.6989 -40.6989 -40.6981 -40.6981 -40.6897 -40.6897 -40.6889 -40.6889 -40.6675 -40.6675 -40.6673 -40.6673 -40.6649 -40.6649 -40.6648 -40.6648 -8.0211 -8.0211 -8.0124 -8.0124 -5.3160 -5.3160 -5.2872 -5.2872 -5.0663 -5.0663 -5.0250 -5.0250 -1.3170 -1.3170 -1.1060 -1.1060 -0.0267 -0.0267 0.0653 0.0653 0.6750 0.6750 0.7651 0.7651 1.5145 1.5145 1.5917 1.5917 2.1749 2.1749 2.2788 2.2788 2.7021 2.7021 3.0554 3.0554 3.7508 3.7508 3.8856 3.8856 4.0560 4.0560 4.1007 4.1007 4.7684 4.7684 4.7824 4.7824 6.6063 6.6063 6.9793 6.9793 7.0195 7.0195 7.0318 7.0318 7.5630 7.5630 7.7586 7.7586 k = 0.0000 0.1567 0.2732 ( 29685 PWs) bands (ev): -40.6988 -40.6988 -40.6980 -40.6980 -40.6898 -40.6898 -40.6890 -40.6890 -40.6675 -40.6675 -40.6673 -40.6673 -40.6649 -40.6649 -40.6648 -40.6648 -8.0172 -8.0172 -8.0080 -8.0080 -5.3291 -5.3291 -5.2959 -5.2959 -5.0668 -5.0668 -5.0240 -5.0240 -1.3279 -1.3279 -1.0860 -1.0860 -0.0297 -0.0297 0.0529 0.0529 0.6860 0.6860 0.7763 0.7763 1.5106 1.5106 1.5781 1.5781 2.1747 2.1747 2.2934 2.2934 2.6707 2.6707 3.0587 3.0587 3.7697 3.7697 3.8672 3.8672 4.0775 4.0775 4.1097 4.1097 4.7648 4.7648 4.7970 4.7970 6.6217 6.6217 6.9814 6.9814 7.0209 7.0209 7.0434 7.0434 7.6173 7.6173 7.8076 7.8076 k = 0.0000 0.1723 0.2732 ( 29689 PWs) bands (ev): -40.6988 -40.6988 -40.6980 -40.6980 -40.6898 -40.6898 -40.6890 -40.6890 -40.6675 -40.6675 -40.6673 -40.6673 -40.6649 -40.6649 -40.6648 -40.6648 -8.0130 -8.0130 -8.0033 -8.0033 -5.3431 -5.3431 -5.3054 -5.3054 -5.0668 -5.0668 -5.0229 -5.0229 -1.3393 -1.3393 -1.0653 -1.0653 -0.0306 -0.0306 0.0388 0.0388 0.6982 0.6982 0.7866 0.7866 1.5087 1.5087 1.5631 1.5631 2.1736 2.1736 2.3053 2.3053 2.6409 2.6409 3.0622 3.0622 3.7921 3.7921 3.8491 3.8491 4.0953 4.0953 4.1199 4.1199 4.7603 4.7603 4.8145 4.8145 6.6413 6.6413 6.9775 6.9775 7.0077 7.0077 7.0716 7.0716 7.6760 7.6760 7.8594 7.8594 k = 0.0000 0.1880 0.2732 ( 29682 PWs) bands (ev): -40.6987 -40.6987 -40.6979 -40.6979 -40.6899 -40.6899 -40.6891 -40.6891 -40.6675 -40.6675 -40.6673 -40.6673 -40.6649 -40.6649 -40.6648 -40.6648 -8.0086 -8.0086 -7.9986 -7.9986 -5.3577 -5.3577 -5.3157 -5.3157 -5.0661 -5.0661 -5.0219 -5.0219 -1.3515 -1.3515 -1.0439 -1.0439 -0.0294 -0.0294 0.0232 0.0232 0.7110 0.7110 0.7958 0.7958 1.5087 1.5087 1.5475 1.5475 2.1714 2.1714 2.3133 2.3133 2.6137 2.6137 3.0662 3.0662 3.8154 3.8154 3.8340 3.8340 4.1097 4.1097 4.1312 4.1312 4.7555 4.7555 4.8331 4.8331 6.6649 6.6649 6.9741 6.9741 6.9897 6.9897 7.1015 7.1015 7.7376 7.7376 7.9138 7.9138 k = 0.0000 0.2037 0.2732 ( 29672 PWs) bands (ev): -40.6986 -40.6986 -40.6978 -40.6978 -40.6899 -40.6899 -40.6891 -40.6891 -40.6675 -40.6675 -40.6673 -40.6673 -40.6649 -40.6649 -40.6647 -40.6647 -8.0039 -8.0039 -7.9937 -7.9937 -5.3728 -5.3728 -5.3266 -5.3266 -5.0650 -5.0650 -5.0208 -5.0208 -1.3641 -1.3641 -1.0219 -1.0219 -0.0263 -0.0263 0.0065 0.0065 0.7240 0.7240 0.8040 0.8040 1.5108 1.5108 1.5318 1.5318 2.1679 2.1679 2.3160 2.3160 2.5899 2.5899 3.0712 3.0712 3.8108 3.8108 3.8513 3.8513 4.1216 4.1216 4.1434 4.1434 4.7507 4.7507 4.8512 4.8512 6.6917 6.6917 6.9674 6.9674 6.9739 6.9739 7.1315 7.1315 7.8010 7.8010 7.9703 7.9703 k = 0.0000 0.2193 0.2732 ( 29662 PWs) bands (ev): -40.6986 -40.6986 -40.6978 -40.6978 -40.6900 -40.6900 -40.6892 -40.6892 -40.6675 -40.6675 -40.6673 -40.6673 -40.6649 -40.6649 -40.6647 -40.6647 -7.9990 -7.9990 -7.9888 -7.9888 -5.3882 -5.3882 -5.3379 -5.3379 -5.0633 -5.0633 -5.0197 -5.0197 -1.3771 -1.3771 -0.9997 -0.9997 -0.0213 -0.0213 -0.0109 -0.0109 0.7370 0.7370 0.8109 0.8109 1.5140 1.5140 1.5171 1.5171 2.1632 2.1632 2.3124 2.3124 2.5703 2.5703 3.0773 3.0773 3.7953 3.7953 3.8840 3.8840 4.1315 4.1315 4.1566 4.1566 4.7461 4.7461 4.8672 4.8672 6.7210 6.7210 6.9422 6.9422 6.9774 6.9774 7.1614 7.1614 7.8652 7.8652 8.0284 8.0284 k = 0.0000 0.2350 0.2732 ( 29656 PWs) bands (ev): -40.6985 -40.6985 -40.6977 -40.6977 -40.6901 -40.6901 -40.6893 -40.6893 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6647 -40.6647 -7.9939 -7.9939 -7.9840 -7.9840 -5.4035 -5.4035 -5.3496 -5.3496 -5.0613 -5.0613 -5.0187 -5.0187 -1.3903 -1.3903 -0.9773 -0.9773 -0.0287 -0.0287 -0.0148 -0.0148 0.7494 0.7494 0.8166 0.8166 1.5018 1.5018 1.5206 1.5206 2.1571 2.1571 2.3021 2.3021 2.5551 2.5551 3.0846 3.0846 3.7803 3.7803 3.9202 3.9202 4.1399 4.1399 4.1712 4.1712 4.7416 4.7416 4.8796 4.8796 6.7510 6.7510 6.9155 6.9155 6.9860 6.9860 7.1911 7.1911 7.9292 7.9292 8.0873 8.0873 k = 0.0000 0.2507 0.2732 ( 29662 PWs) bands (ev): -40.6985 -40.6985 -40.6977 -40.6977 -40.6901 -40.6901 -40.6893 -40.6893 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6647 -40.6647 -7.9888 -7.9888 -7.9793 -7.9793 -5.4186 -5.4186 -5.3614 -5.3614 -5.0589 -5.0589 -5.0178 -5.0178 -1.4035 -1.4035 -0.9551 -0.9551 -0.0465 -0.0465 -0.0069 -0.0069 0.7609 0.7609 0.8210 0.8210 1.4890 1.4890 1.5278 1.5278 2.1497 2.1497 2.2855 2.2855 2.5440 2.5440 3.0934 3.0934 3.7664 3.7664 3.9590 3.9590 4.1477 4.1477 4.1875 4.1875 4.7371 4.7371 4.8871 4.8871 6.7769 6.7769 6.8922 6.8922 7.0001 7.0001 7.2206 7.2206 7.9923 7.9923 8.1462 8.1462 k = 0.0000 0.2663 0.2732 ( 29667 PWs) bands (ev): -40.6984 -40.6984 -40.6976 -40.6976 -40.6902 -40.6902 -40.6894 -40.6894 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6647 -40.6647 -7.9837 -7.9837 -7.9748 -7.9748 -5.4332 -5.4332 -5.3731 -5.3731 -5.0562 -5.0562 -5.0169 -5.0169 -1.4164 -1.4164 -0.9332 -0.9332 -0.0641 -0.0641 0.0019 0.0019 0.7713 0.7713 0.8244 0.8244 1.4781 1.4781 1.5362 1.5362 2.1410 2.1410 2.2636 2.2636 2.5359 2.5359 3.1035 3.1035 3.7540 3.7540 3.9990 3.9990 4.1557 4.1557 4.2060 4.2060 4.7326 4.7326 4.8889 4.8889 6.7856 6.7856 6.8857 6.8857 7.0197 7.0197 7.2500 7.2500 8.0535 8.0535 8.2044 8.2044 k = 0.0000 0.2820 0.2732 ( 29680 PWs) bands (ev): -40.6984 -40.6984 -40.6976 -40.6976 -40.6902 -40.6902 -40.6894 -40.6894 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6647 -40.6647 -7.9786 -7.9786 -7.9705 -7.9705 -5.4471 -5.4471 -5.3847 -5.3847 -5.0533 -5.0533 -5.0163 -5.0163 -1.4289 -1.4289 -0.9119 -0.9119 -0.0811 -0.0811 0.0114 0.0114 0.7801 0.7801 0.8268 0.8268 1.4696 1.4696 1.5456 1.5456 2.1314 2.1314 2.2379 2.2379 2.5297 2.5297 3.1148 3.1148 3.7429 3.7429 4.0386 4.0386 4.1646 4.1646 4.2277 4.2277 4.7278 4.7278 4.8845 4.8845 6.7676 6.7676 6.9057 6.9057 7.0442 7.0442 7.2796 7.2796 8.1120 8.1120 8.2609 8.2609 k = 0.0000 0.2977 0.2732 ( 29683 PWs) bands (ev): -40.6983 -40.6983 -40.6975 -40.6975 -40.6903 -40.6903 -40.6895 -40.6895 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6647 -40.6647 -7.9736 -7.9736 -7.9666 -7.9666 -5.4602 -5.4602 -5.3960 -5.3960 -5.0503 -5.0503 -5.0159 -5.0159 -1.4408 -1.4408 -0.8915 -0.8915 -0.0973 -0.0973 0.0212 0.0212 0.7872 0.7872 0.8284 0.8284 1.4639 1.4639 1.5555 1.5555 2.1209 2.1209 2.2099 2.2099 2.5246 2.5246 3.1272 3.1272 3.7333 3.7333 4.0756 4.0756 4.1752 4.1752 4.2538 4.2538 4.7222 4.7222 4.8739 4.8739 6.7358 6.7358 6.9394 6.9394 7.0727 7.0727 7.3097 7.3097 8.1662 8.1662 8.3148 8.3148 k = 0.0000 0.3133 0.2732 ( 29672 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6904 -40.6904 -40.6896 -40.6896 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9687 -7.9687 -7.9630 -7.9630 -5.4722 -5.4722 -5.4067 -5.4067 -5.0472 -5.0472 -5.0157 -5.0157 -1.4517 -1.4517 -0.8722 -0.8722 -0.1125 -0.1125 0.0310 0.0310 0.7925 0.7925 0.8294 0.8294 1.4610 1.4610 1.5655 1.5655 2.1099 2.1099 2.1805 2.1805 2.5197 2.5197 3.1404 3.1404 3.7249 3.7249 4.1079 4.1079 4.1879 4.1879 4.2857 4.2857 4.7155 4.7155 4.8575 4.8575 6.6997 6.6997 6.9774 6.9774 7.1036 7.1036 7.3407 7.3407 8.2145 8.2145 8.3651 8.3651 k = 0.0000 0.3290 0.2732 ( 29680 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6904 -40.6904 -40.6896 -40.6896 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9640 -7.9640 -7.9599 -7.9599 -5.4829 -5.4829 -5.4169 -5.4169 -5.0441 -5.0441 -5.0159 -5.0159 -1.4616 -1.4616 -0.8543 -0.8543 -0.1265 -0.1265 0.0405 0.0405 0.7960 0.7960 0.8300 0.8300 1.4609 1.4609 1.5751 1.5751 2.0989 2.0989 2.1510 2.1510 2.5148 2.5148 3.1541 3.1541 3.7179 3.7179 4.1341 4.1341 4.2033 4.2033 4.3237 4.3237 4.7074 4.7074 4.8360 4.8360 6.6628 6.6628 7.0162 7.0162 7.1350 7.1350 7.3730 7.3730 8.2547 8.2547 8.4110 8.4110 k = 0.0000 0.3447 0.2732 ( 29689 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6905 -40.6905 -40.6897 -40.6897 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9596 -7.9596 -7.9573 -7.9573 -5.4922 -5.4922 -5.4262 -5.4262 -5.0410 -5.0410 -5.0165 -5.0165 -1.4702 -1.4702 -0.8380 -0.8380 -0.1391 -0.1391 0.0492 0.0492 0.7977 0.7977 0.8306 0.8306 1.4635 1.4635 1.5839 1.5839 2.0881 2.0881 2.1220 2.1220 2.5098 2.5098 3.1680 3.1680 3.7119 3.7119 4.1544 4.1544 4.2216 4.2216 4.3664 4.3664 4.6976 4.6976 4.8105 4.8105 6.6269 6.6269 7.0542 7.0542 7.1651 7.1651 7.4063 7.4063 8.2845 8.2845 8.4512 8.4512 k = 0.0000 0.3603 0.2732 ( 29689 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6905 -40.6905 -40.6897 -40.6897 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9554 -7.9554 -7.9553 -7.9553 -5.5000 -5.5000 -5.4346 -5.4346 -5.0379 -5.0379 -5.0174 -5.0174 -1.4774 -1.4774 -0.8235 -0.8235 -0.1502 -0.1502 0.0569 0.0569 0.7980 0.7980 0.8313 0.8313 1.4684 1.4684 1.5912 1.5912 2.0782 2.0782 2.0946 2.0946 2.5044 2.5044 3.1818 3.1818 3.7068 3.7068 4.1700 4.1700 4.2430 4.2430 4.4112 4.4112 4.6860 4.6860 4.7822 4.7822 6.5934 6.5934 7.0899 7.0899 7.1922 7.1922 7.4397 7.4397 8.3025 8.3025 8.4850 8.4850 k = 0.0000 0.3760 0.2732 ( 29681 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6905 -40.6905 -40.6897 -40.6897 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9539 -7.9539 -7.9516 -7.9516 -5.5061 -5.5061 -5.4420 -5.4420 -5.0350 -5.0350 -5.0188 -5.0188 -1.4831 -1.4831 -0.8110 -0.8110 -0.1597 -0.1597 0.0634 0.0634 0.7970 0.7970 0.8324 0.8324 1.4750 1.4750 1.5966 1.5966 2.0677 2.0677 2.0712 2.0712 2.4989 2.4989 3.1950 3.1950 3.7025 3.7025 4.1822 4.1822 4.2670 4.2670 4.4547 4.4547 4.6734 4.6734 4.7526 4.7526 6.5633 6.5633 7.1222 7.1222 7.2154 7.2154 7.4714 7.4714 8.3088 8.3088 8.5116 8.5116 k = 0.0000 0.3917 0.2732 ( 29700 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9531 -7.9531 -7.9482 -7.9482 -5.5105 -5.5105 -5.4483 -5.4483 -5.0322 -5.0322 -5.0207 -5.0207 -1.4872 -1.4872 -0.8007 -0.8007 -0.1675 -0.1675 0.0683 0.0683 0.7951 0.7951 0.8340 0.8340 1.4825 1.4825 1.5997 1.5997 2.0467 2.0467 2.0633 2.0633 2.4931 2.4931 3.2074 3.2074 3.6988 3.6988 4.1918 4.1918 4.2932 4.2932 4.4921 4.4921 4.6623 4.6623 4.7234 4.7234 6.5377 6.5377 7.1500 7.1500 7.2343 7.2343 7.4983 7.4983 8.3060 8.3060 8.5304 8.5304 k = 0.0000 0.4073 0.2732 ( 29693 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9529 -7.9529 -7.9452 -7.9452 -5.5130 -5.5130 -5.4534 -5.4534 -5.0296 -5.0296 -5.0230 -5.0230 -1.4895 -1.4895 -0.7928 -0.7928 -0.1737 -0.1737 0.0716 0.0716 0.7926 0.7926 0.8365 0.8365 1.4903 1.4903 1.6000 1.6000 2.0285 2.0285 2.0587 2.0587 2.4872 2.4872 3.2187 3.2187 3.6957 3.6957 4.1996 4.1996 4.3203 4.3203 4.5156 4.5156 4.6586 4.6586 4.6969 4.6969 6.5174 6.5174 7.1723 7.1723 7.2487 7.2487 7.5167 7.5167 8.2983 8.2983 8.5415 8.5415 k = 0.0000 0.4230 0.2732 ( 29692 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9535 -7.9535 -7.9426 -7.9426 -5.5137 -5.5137 -5.4573 -5.4573 -5.0272 -5.0272 -5.0258 -5.0258 -1.4902 -1.4902 -0.7872 -0.7872 -0.1783 -0.1783 0.0732 0.0732 0.7897 0.7897 0.8397 0.8397 1.4974 1.4974 1.5973 1.5973 2.0149 2.0149 2.0566 2.0566 2.4813 2.4813 3.2287 3.2287 3.6930 3.6930 4.2060 4.2060 4.3460 4.3460 4.5173 4.5173 4.6678 4.6678 4.6770 4.6770 6.5031 6.5031 7.1883 7.1883 7.2587 7.2587 7.5232 7.5232 8.2898 8.2898 8.5462 8.5462 k = 0.0000 0.4230 0.2732 ( 29692 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9535 -7.9535 -7.9426 -7.9426 -5.5137 -5.5137 -5.4573 -5.4573 -5.0272 -5.0272 -5.0258 -5.0258 -1.4902 -1.4902 -0.7872 -0.7872 -0.1783 -0.1783 0.0732 0.0732 0.7897 0.7897 0.8397 0.8397 1.4974 1.4974 1.5973 1.5973 2.0149 2.0149 2.0566 2.0566 2.4813 2.4813 3.2287 3.2287 3.6930 3.6930 4.2060 4.2060 4.3460 4.3460 4.5173 4.5173 4.6678 4.6678 4.6770 4.6770 6.5031 6.5031 7.1883 7.1883 7.2587 7.2587 7.5232 7.5232 8.2898 8.2898 8.5462 8.5462 k = 0.0000 0.4242 0.2584 ( 29692 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9527 -7.9527 -7.9435 -7.9435 -5.5104 -5.5104 -5.4525 -5.4525 -5.0329 -5.0329 -5.0301 -5.0301 -1.4832 -1.4832 -0.7944 -0.7944 -0.1775 -0.1775 0.0690 0.0690 0.7952 0.7952 0.8425 0.8425 1.5031 1.5031 1.6005 1.6005 2.0179 2.0179 2.0582 2.0582 2.4837 2.4837 3.2101 3.2101 3.6984 3.6984 4.2001 4.2001 4.3302 4.3302 4.5022 4.5022 4.6701 4.6701 4.6811 4.6811 6.5208 6.5208 7.1998 7.1998 7.2296 7.2296 7.5673 7.5673 8.2819 8.2819 8.5306 8.5306 k = 0.0000 0.4254 0.2436 ( 29701 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9520 -7.9520 -7.9444 -7.9444 -5.5054 -5.5054 -5.4464 -5.4464 -5.0400 -5.0400 -5.0367 -5.0367 -1.4735 -1.4735 -0.8039 -0.8039 -0.1767 -0.1767 0.0632 0.0632 0.8018 0.8018 0.8469 0.8469 1.5112 1.5112 1.6032 1.6032 2.0213 2.0213 2.0608 2.0608 2.4860 2.4860 3.1874 3.1874 3.7047 3.7047 4.1926 4.1926 4.3130 4.3130 4.4779 4.4779 4.6765 4.6765 4.6869 4.6869 6.5431 6.5431 7.2011 7.2011 7.2168 7.2168 7.6106 7.6106 8.2709 8.2709 8.5060 8.5060 k = 0.0000 0.4267 0.2288 ( 29705 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9515 -7.9515 -7.9452 -7.9452 -5.4987 -5.4987 -5.4391 -5.4391 -5.0485 -5.0485 -5.0452 -5.0452 -1.4610 -1.4610 -0.8155 -0.8155 -0.1757 -0.1757 0.0559 0.0559 0.8094 0.8094 0.8527 0.8527 1.5213 1.5213 1.6053 1.6053 2.0250 2.0250 2.0642 2.0642 2.4885 2.4885 3.1611 3.1611 3.7116 3.7116 4.1833 4.1833 4.2951 4.2951 4.4484 4.4484 4.6844 4.6844 4.6934 4.6934 6.5695 6.5695 7.1761 7.1761 7.2374 7.2374 7.6521 7.6521 8.2569 8.2569 8.4736 8.4736 k = 0.0000 0.4279 0.2140 ( 29703 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6648 -40.6648 -40.6646 -40.6646 -7.9510 -7.9510 -7.9460 -7.9460 -5.4904 -5.4904 -5.4306 -5.4306 -5.0583 -5.0583 -5.0557 -5.0557 -1.4460 -1.4460 -0.8293 -0.8293 -0.1743 -0.1743 0.0472 0.0472 0.8178 0.8178 0.8597 0.8597 1.5330 1.5330 1.6071 1.6071 2.0289 2.0289 2.0682 2.0682 2.4918 2.4918 3.1319 3.1319 3.7189 3.7189 4.1714 4.1714 4.2771 4.2771 4.4170 4.4170 4.6925 4.6925 4.7001 4.7001 6.5991 6.5991 7.1536 7.1536 7.2630 7.2630 7.6909 7.6909 8.2405 8.2405 8.4354 8.4354 k = 0.0000 0.4291 0.1992 ( 29724 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6648 -40.6648 -40.6646 -40.6646 -7.9507 -7.9507 -7.9467 -7.9467 -5.4805 -5.4805 -5.4210 -5.4210 -5.0694 -5.0694 -5.0679 -5.0679 -1.4284 -1.4284 -0.8452 -0.8452 -0.1725 -0.1725 0.0374 0.0374 0.8269 0.8269 0.8675 0.8675 1.5457 1.5457 1.6085 1.6085 2.0330 2.0330 2.0727 2.0727 2.4961 2.4961 3.1000 3.1000 3.7263 3.7263 4.1562 4.1562 4.2598 4.2598 4.3858 4.3858 4.6998 4.6998 4.7065 4.7065 6.6314 6.6314 7.1339 7.1339 7.2931 7.2931 7.7262 7.7262 8.2219 8.2219 8.3935 8.3935 k = 0.0000 0.4303 0.1844 ( 29701 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6648 -40.6648 -40.6646 -40.6646 -7.9504 -7.9504 -7.9474 -7.9474 -5.4692 -5.4692 -5.4103 -5.4103 -5.0819 -5.0819 -5.0816 -5.0816 -1.4086 -1.4086 -0.8632 -0.8632 -0.1700 -0.1700 0.0266 0.0266 0.8364 0.8364 0.8757 0.8757 1.5591 1.5591 1.6098 1.6098 2.0372 2.0372 2.0775 2.0775 2.5019 2.5019 3.0661 3.0661 3.7339 3.7339 4.1371 4.1371 4.2436 4.2436 4.3566 4.3566 4.7061 4.7061 4.7125 4.7125 6.6658 6.6658 7.1172 7.1172 7.3274 7.3274 7.7573 7.7573 8.2020 8.2020 8.3497 8.3497 k = 0.0000 0.4315 0.1696 ( 29693 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6648 -40.6648 -40.6646 -40.6646 -7.9502 -7.9502 -7.9480 -7.9480 -5.4564 -5.4564 -5.3986 -5.3986 -5.0972 -5.0972 -5.0948 -5.0948 -1.3867 -1.3867 -0.8832 -0.8832 -0.1668 -0.1668 0.0151 0.0151 0.8463 0.8463 0.8840 0.8840 1.5726 1.5726 1.6110 1.6110 2.0415 2.0415 2.0823 2.0823 2.5097 2.5097 3.0305 3.0305 3.7417 3.7417 4.1139 4.1139 4.2289 4.2289 4.3305 4.3305 4.7113 4.7113 4.7179 4.7179 6.7016 6.7016 7.1033 7.1033 7.3654 7.3654 7.7831 7.7831 8.1816 8.1816 8.3055 8.3055 k = 0.0000 0.4328 0.1548 ( 29685 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6648 -40.6648 -40.6646 -40.6646 -7.9501 -7.9501 -7.9486 -7.9486 -5.4423 -5.4423 -5.3860 -5.3860 -5.1138 -5.1138 -5.1089 -5.1089 -1.3628 -1.3628 -0.9051 -0.9051 -0.1627 -0.1627 0.0029 0.0029 0.8563 0.8563 0.8921 0.8921 1.5855 1.5855 1.6123 1.6123 2.0460 2.0460 2.0868 2.0868 2.5198 2.5198 2.9937 2.9937 3.7497 3.7497 4.0870 4.0870 4.2164 4.2164 4.3079 4.3079 4.7157 4.7157 4.7224 4.7224 6.7384 6.7384 7.0917 7.0917 7.4065 7.4065 7.8027 7.8027 8.1617 8.1617 8.2623 8.2623 k = 0.0000 0.4340 0.1400 ( 29689 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6674 -40.6674 -40.6648 -40.6648 -40.6646 -40.6646 -7.9501 -7.9501 -7.9490 -7.9490 -5.4270 -5.4270 -5.3728 -5.3728 -5.1314 -5.1314 -5.1238 -5.1238 -1.3373 -1.3373 -0.9288 -0.9288 -0.1577 -0.1577 -0.0096 -0.0096 0.8662 0.8662 0.8996 0.8996 1.5973 1.5973 1.6138 1.6138 2.0507 2.0507 2.0908 2.0908 2.5325 2.5325 2.9560 2.9560 3.7581 3.7581 4.0571 4.0571 4.2061 4.2061 4.2886 4.2886 4.7192 4.7192 4.7262 4.7262 6.7755 6.7755 7.0821 7.0821 7.4497 7.4497 7.8151 7.8151 8.1436 8.1436 8.2213 8.2213 k = 0.0000 0.4352 0.1252 ( 29687 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6674 -40.6674 -40.6648 -40.6648 -40.6647 -40.6647 -7.9501 -7.9501 -7.9494 -7.9494 -5.4107 -5.4107 -5.3590 -5.3590 -5.1498 -5.1498 -5.1392 -5.1392 -1.3102 -1.3102 -0.9541 -0.9541 -0.1517 -0.1517 -0.0225 -0.0225 0.8758 0.8758 0.9063 0.9063 1.6075 1.6075 1.6156 1.6156 2.0557 2.0557 2.0940 2.0940 2.5480 2.5480 2.9178 2.9178 3.7671 3.7671 4.0255 4.0255 4.1984 4.1984 4.2720 4.2720 4.7222 4.7222 4.7292 4.7292 6.8126 6.8126 7.0736 7.0736 7.4941 7.4941 7.8197 7.8197 8.1279 8.1279 8.1837 8.1837 k = 0.0000 0.4364 0.1104 ( 29704 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6674 -40.6674 -40.6648 -40.6648 -40.6647 -40.6647 -7.9502 -7.9502 -7.9498 -7.9498 -5.3935 -5.3935 -5.3449 -5.3449 -5.1685 -5.1685 -5.1551 -5.1551 -1.2819 -1.2819 -0.9809 -0.9809 -0.1448 -0.1448 -0.0354 -0.0354 0.8850 0.8850 0.9118 0.9118 1.6156 1.6156 1.6180 1.6180 2.0610 2.0610 2.0962 2.0962 2.5663 2.5663 2.8795 2.8795 3.7771 3.7771 3.9934 3.9934 4.1934 4.1934 4.2574 4.2574 4.7246 4.7246 4.7314 4.7314 6.8489 6.8489 7.0655 7.0655 7.5386 7.5386 7.8167 7.8167 8.1148 8.1148 8.1505 8.1505 k = 0.0000 0.4376 0.0956 ( 29707 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6674 -40.6674 -40.6648 -40.6648 -40.6647 -40.6647 -7.9502 -7.9502 -7.9500 -7.9500 -5.3756 -5.3756 -5.3310 -5.3310 -5.1870 -5.1870 -5.1711 -5.1711 -1.2526 -1.2526 -1.0089 -1.0089 -0.1370 -0.1370 -0.0483 -0.0483 0.8935 0.8935 0.9159 0.9159 1.6196 1.6196 1.6227 1.6227 2.0666 2.0666 2.0973 2.0973 2.5876 2.5876 2.8415 2.8415 3.7885 3.7885 3.9618 3.9618 4.1910 4.1910 4.2444 4.2444 4.7267 4.7267 4.7328 4.7328 6.8839 6.8839 7.0567 7.0567 7.5819 7.5819 7.8071 7.8071 8.1039 8.1039 8.1228 8.1228 k = 0.0000 0.4388 0.0808 ( 29703 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6674 -40.6674 -40.6648 -40.6648 -40.6647 -40.6647 -7.9503 -7.9503 -7.9502 -7.9502 -5.3575 -5.3575 -5.3182 -5.3182 -5.2045 -5.2045 -5.1870 -5.1870 -1.2224 -1.2224 -1.0381 -1.0381 -0.1282 -0.1282 -0.0611 -0.0611 0.9010 0.9010 0.9185 0.9185 1.6222 1.6222 1.6268 1.6268 2.0725 2.0725 2.0970 2.0970 2.6116 2.6116 2.8040 2.8040 3.8016 3.8016 3.9317 3.9317 4.1912 4.1912 4.2326 4.2326 4.7285 4.7285 4.7336 4.7336 6.9170 6.9170 7.0464 7.0464 7.6229 7.6229 7.7920 7.7920 8.0946 8.0946 8.1015 8.1015 k = 0.0000 0.4401 0.0660 ( 29700 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6674 -40.6674 -40.6648 -40.6648 -40.6647 -40.6647 -7.9504 -7.9504 -7.9503 -7.9503 -5.3396 -5.3396 -5.3082 -5.3082 -5.2189 -5.2189 -5.2022 -5.2022 -1.1917 -1.1917 -1.0680 -1.0680 -0.1187 -0.1187 -0.0736 -0.0736 0.9075 0.9075 0.9195 0.9195 1.6248 1.6248 1.6290 1.6290 2.0783 2.0783 2.0955 2.0955 2.6384 2.6384 2.7676 2.7676 3.8169 3.8169 3.9036 3.9036 4.1937 4.1937 4.2220 4.2220 4.7301 4.7301 4.7337 4.7337 6.9473 6.9473 7.0336 7.0336 7.6606 7.6606 7.7729 7.7729 8.0862 8.0862 8.0875 8.0875 k = 0.0000 0.4413 0.0512 ( 29699 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6675 -40.6675 -40.6647 -40.6647 -40.6647 -40.6647 -7.9504 -7.9504 -7.9504 -7.9504 -5.3231 -5.3231 -5.3046 -5.3046 -5.2267 -5.2267 -5.2155 -5.2155 -1.1607 -1.1607 -1.0986 -1.0986 -0.1083 -0.1083 -0.0857 -0.0857 0.9128 0.9128 0.9189 0.9189 1.6271 1.6271 1.6296 1.6296 2.0838 2.0838 2.0926 2.0926 2.6676 2.6676 2.7325 2.7325 3.8346 3.8346 3.8779 3.8779 4.1983 4.1983 4.2127 4.2127 4.7315 4.7315 4.7334 4.7334 6.9745 6.9745 7.0176 7.0176 7.6945 7.6945 7.7503 7.7503 8.0792 8.0792 8.0808 8.0808 k = 0.0000 0.4425 0.0364 ( 29696 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6675 -40.6675 -40.6647 -40.6647 -40.6647 -40.6647 -7.9504 -7.9504 -7.9504 -7.9504 -5.3102 -5.3102 -5.3102 -5.3102 -5.2250 -5.2250 -5.2249 -5.2249 -1.1296 -1.1296 -1.1295 -1.1295 -0.0973 -0.0973 -0.0973 -0.0973 0.9166 0.9166 0.9167 0.9167 1.6288 1.6288 1.6289 1.6289 2.0886 2.0886 2.0887 2.0887 2.6990 2.6990 2.6992 2.6992 3.8548 3.8548 3.8549 3.8549 4.2046 4.2046 4.2048 4.2048 4.7325 4.7325 4.7327 4.7327 6.9979 6.9979 6.9980 6.9980 7.7242 7.7242 7.7243 7.7243 8.0776 8.0776 8.0777 8.0777 k = 0.0000 0.4425 0.0364 ( 29696 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6675 -40.6675 -40.6647 -40.6647 -40.6647 -40.6647 -7.9504 -7.9504 -7.9504 -7.9504 -5.3102 -5.3102 -5.3102 -5.3102 -5.2250 -5.2250 -5.2249 -5.2249 -1.1296 -1.1296 -1.1295 -1.1295 -0.0973 -0.0973 -0.0973 -0.0973 0.9166 0.9166 0.9167 0.9167 1.6288 1.6288 1.6289 1.6289 2.0886 2.0886 2.0887 2.0887 2.6990 2.6990 2.6992 2.6992 3.8548 3.8548 3.8549 3.8549 4.2046 4.2046 4.2048 4.2048 4.7325 4.7325 4.7327 4.7327 6.9979 6.9979 6.9980 6.9980 7.7242 7.7242 7.7243 7.7243 8.0776 8.0776 8.0777 8.0777 k = 0.0156 0.4425 0.0364 ( 29698 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6675 -40.6675 -40.6647 -40.6647 -40.6647 -40.6647 -7.9496 -7.9496 -7.9495 -7.9495 -5.3418 -5.3418 -5.3405 -5.3405 -5.1946 -5.1946 -5.1934 -5.1934 -1.1366 -1.1366 -1.1353 -1.1353 -0.0921 -0.0921 -0.0903 -0.0903 0.9103 0.9103 0.9119 0.9119 1.6344 1.6344 1.6351 1.6351 2.0822 2.0822 2.0846 2.0846 2.7030 2.7030 2.7054 2.7054 3.8542 3.8542 3.8544 3.8544 4.2046 4.2046 4.2060 4.2060 4.7334 4.7334 4.7342 4.7342 6.9975 6.9975 6.9980 6.9980 7.7237 7.7237 7.7243 7.7243 8.0782 8.0782 8.0784 8.0784 k = 0.0312 0.4425 0.0364 ( 29688 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6675 -40.6675 -40.6648 -40.6648 -40.6647 -40.6647 -7.9470 -7.9470 -7.9469 -7.9469 -5.3956 -5.3956 -5.3940 -5.3940 -5.1409 -5.1409 -5.1397 -5.1397 -1.1560 -1.1560 -1.1536 -1.1536 -0.0752 -0.0752 -0.0716 -0.0716 0.8936 0.8936 0.8967 0.8967 1.6510 1.6510 1.6522 1.6522 2.0664 2.0664 2.0710 2.0710 2.7166 2.7166 2.7212 2.7212 3.8525 3.8525 3.8529 3.8529 4.2057 4.2057 4.2083 4.2083 4.7364 4.7364 4.7380 4.7380 6.9967 6.9967 6.9976 6.9976 7.7228 7.7228 7.7240 7.7240 8.0801 8.0801 8.0805 8.0805 k = 0.0469 0.4425 0.0364 ( 29692 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6674 -40.6674 -40.6648 -40.6648 -40.6647 -40.6647 -7.9427 -7.9427 -7.9426 -7.9426 -5.4533 -5.4533 -5.4516 -5.4516 -5.0833 -5.0833 -5.0821 -5.0821 -1.1865 -1.1865 -1.1831 -1.1831 -0.0477 -0.0477 -0.0425 -0.0425 0.8686 0.8686 0.8729 0.8729 1.6755 1.6755 1.6769 1.6769 2.0442 2.0442 2.0506 2.0506 2.7382 2.7382 2.7445 2.7445 3.8501 3.8501 3.8506 3.8506 4.2079 4.2079 4.2117 4.2117 4.7417 4.7417 4.7439 4.7439 6.9957 6.9957 6.9969 6.9969 7.7215 7.7215 7.7233 7.7233 8.0833 8.0833 8.0839 8.0839 k = 0.0625 0.4425 0.0364 ( 29696 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6675 -40.6675 -40.6674 -40.6674 -40.6648 -40.6648 -40.6647 -40.6647 -7.9367 -7.9367 -7.9365 -7.9365 -5.5122 -5.5122 -5.5104 -5.5104 -5.0245 -5.0245 -5.0233 -5.0233 -1.2264 -1.2264 -1.2223 -1.2223 -0.0112 -0.0112 -0.0047 -0.0047 0.8374 0.8374 0.8427 0.8427 1.7031 1.7031 1.7041 1.7041 2.0206 2.0206 2.0278 2.0278 2.7657 2.7657 2.7733 2.7733 3.8473 3.8473 3.8478 3.8478 4.2108 4.2108 4.2158 4.2158 4.7489 4.7489 4.7519 4.7519 6.9946 6.9946 6.9962 6.9962 7.7198 7.7198 7.7222 7.7222 8.0880 8.0880 8.0886 8.0886 k = 0.0781 0.4425 0.0364 ( 29704 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6905 -40.6905 -40.6898 -40.6898 -40.6675 -40.6675 -40.6674 -40.6674 -40.6648 -40.6648 -40.6647 -40.6647 -7.9290 -7.9290 -7.9287 -7.9287 -5.5715 -5.5715 -5.5697 -5.5697 -4.9651 -4.9651 -4.9641 -4.9641 -1.2742 -1.2742 -1.2695 -1.2695 0.0323 0.0323 0.0400 0.0400 0.8023 0.8023 0.8085 0.8085 1.7261 1.7261 1.7264 1.7264 2.0028 2.0028 2.0100 2.0100 2.7970 2.7970 2.8055 2.8055 3.8448 3.8448 3.8450 3.8450 4.2144 4.2144 4.2204 4.2204 4.7578 4.7578 4.7615 4.7615 6.9938 6.9938 6.9957 6.9957 7.7180 7.7180 7.7210 7.7210 8.0940 8.0940 8.0946 8.0946 k = 0.0938 0.4425 0.0364 ( 29720 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6905 -40.6905 -40.6897 -40.6897 -40.6675 -40.6675 -40.6674 -40.6674 -40.6648 -40.6648 -40.6648 -40.6648 -7.9195 -7.9195 -7.9191 -7.9191 -5.6311 -5.6311 -5.6292 -5.6292 -4.9054 -4.9054 -4.9045 -4.9045 -1.3282 -1.3282 -1.3230 -1.3230 0.0812 0.0812 0.0899 0.0899 0.7653 0.7653 0.7721 0.7721 1.7331 1.7331 1.7356 1.7356 2.0003 2.0003 2.0062 2.0062 2.8305 2.8305 2.8396 2.8396 3.8428 3.8428 3.8431 3.8431 4.2184 4.2184 4.2254 4.2254 4.7680 4.7680 4.7724 4.7724 6.9936 6.9936 6.9957 6.9957 7.7160 7.7160 7.7197 7.7197 8.1011 8.1011 8.1017 8.1017 k = 0.1094 0.4425 0.0364 ( 29734 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6905 -40.6905 -40.6897 -40.6897 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6648 -40.6648 -7.9083 -7.9083 -7.9079 -7.9079 -5.6908 -5.6908 -5.6889 -5.6889 -4.8455 -4.8455 -4.8446 -4.8446 -1.3871 -1.3871 -1.3817 -1.3817 0.1338 0.1338 0.1434 0.1434 0.7280 0.7280 0.7354 0.7354 1.7190 1.7190 1.7242 1.7242 2.0184 2.0184 2.0228 2.0228 2.8648 2.8648 2.8742 2.8742 3.8416 3.8416 3.8427 3.8427 4.2226 4.2226 4.2304 4.2304 4.7792 4.7792 4.7842 4.7842 6.9943 6.9943 6.9967 6.9967 7.7142 7.7142 7.7185 7.7185 8.1093 8.1093 8.1097 8.1097 k = 0.1250 0.4425 0.0364 ( 29724 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6905 -40.6905 -40.6897 -40.6897 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6648 -40.6648 -7.8955 -7.8955 -7.8950 -7.8950 -5.7507 -5.7507 -5.7487 -5.7487 -4.7853 -4.7853 -4.7845 -4.7845 -1.4499 -1.4499 -1.4443 -1.4443 0.1886 0.1886 0.1990 0.1990 0.6919 0.6919 0.6999 0.6999 1.6871 1.6871 1.6943 1.6943 2.0534 2.0534 2.0570 2.0570 2.8991 2.8991 2.9086 2.9086 3.8420 3.8420 3.8441 3.8441 4.2269 4.2269 4.2354 4.2354 4.7909 4.7909 4.7966 4.7966 6.9964 6.9964 6.9989 6.9989 7.7127 7.7127 7.7175 7.7175 8.1181 8.1181 8.1184 8.1184 k = 0.1406 0.4425 0.0364 ( 29722 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6905 -40.6905 -40.6897 -40.6897 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -7.8809 -7.8809 -7.8804 -7.8804 -5.8105 -5.8105 -5.8085 -5.8085 -4.7249 -4.7249 -4.7243 -4.7243 -1.5158 -1.5158 -1.5101 -1.5101 0.2440 0.2440 0.2549 0.2549 0.6587 0.6587 0.6671 0.6671 1.6441 1.6441 1.6527 1.6527 2.0979 2.0979 2.1015 2.1015 2.9327 2.9327 2.9424 2.9424 3.8445 3.8445 3.8478 3.8478 4.2310 4.2310 4.2403 4.2403 4.8027 4.8027 4.8089 4.8089 7.0003 7.0003 7.0030 7.0030 7.7116 7.7116 7.7170 7.7170 8.1272 8.1272 8.1273 8.1273 k = 0.1562 0.4425 0.0364 ( 29732 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6904 -40.6904 -40.6896 -40.6896 -40.6674 -40.6674 -40.6673 -40.6673 -40.6650 -40.6650 -40.6649 -40.6649 -7.8647 -7.8647 -7.8641 -7.8641 -5.8704 -5.8704 -5.8683 -5.8683 -4.6643 -4.6643 -4.6637 -4.6637 -1.5841 -1.5841 -1.5784 -1.5784 0.2974 0.2974 0.3088 0.3088 0.6305 0.6305 0.6394 0.6394 1.5951 1.5951 1.6044 1.6044 2.1463 2.1463 2.1504 2.1504 2.9655 2.9655 2.9753 2.9753 3.8494 3.8494 3.8541 3.8541 4.2349 4.2349 4.2449 4.2449 4.8141 4.8141 4.8209 4.8209 7.0065 7.0065 7.0092 7.0092 7.7112 7.7112 7.7171 7.7171 8.1360 8.1360 8.1362 8.1362 k = 0.1719 0.4425 0.0364 ( 29738 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6904 -40.6904 -40.6896 -40.6896 -40.6674 -40.6674 -40.6673 -40.6673 -40.6650 -40.6650 -40.6649 -40.6649 -7.8468 -7.8468 -7.8461 -7.8461 -5.9302 -5.9302 -5.9281 -5.9281 -4.6034 -4.6034 -4.6030 -4.6030 -1.6544 -1.6544 -1.6487 -1.6487 0.3451 0.3451 0.3567 0.3567 0.6112 0.6112 0.6207 0.6207 1.5427 1.5427 1.5526 1.5526 2.1948 2.1948 2.1999 2.1999 2.9977 2.9977 3.0077 3.0077 3.8570 3.8570 3.8633 3.8633 4.2386 4.2386 4.2492 4.2492 4.8247 4.8247 4.8320 4.8320 7.0152 7.0152 7.0179 7.0179 7.7117 7.7117 7.7180 7.7180 8.1442 8.1442 8.1446 8.1446 k = 0.1875 0.4425 0.0364 ( 29738 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6904 -40.6904 -40.6896 -40.6896 -40.6673 -40.6673 -40.6673 -40.6673 -40.6650 -40.6650 -40.6650 -40.6650 -7.8272 -7.8272 -7.8265 -7.8265 -5.9899 -5.9899 -5.9877 -5.9877 -4.5422 -4.5422 -4.5419 -4.5419 -1.7261 -1.7261 -1.7205 -1.7205 0.3806 0.3806 0.3920 0.3920 0.6069 0.6069 0.6175 0.6175 1.4888 1.4888 1.4991 1.4991 2.2408 2.2408 2.2472 2.2472 3.0298 3.0298 3.0401 3.0401 3.8674 3.8674 3.8753 3.8753 4.2421 4.2421 4.2532 4.2532 4.8341 4.8341 4.8419 4.8419 7.0269 7.0269 7.0296 7.0296 7.7132 7.7132 7.7198 7.7198 8.1515 8.1515 8.1520 8.1520 k = 0.2031 0.4425 0.0364 ( 29730 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6903 -40.6903 -40.6895 -40.6895 -40.6673 -40.6673 -40.6673 -40.6673 -40.6651 -40.6651 -40.6650 -40.6650 -7.8061 -7.8061 -7.8053 -7.8053 -6.0494 -6.0494 -6.0473 -6.0473 -4.4807 -4.4807 -4.4806 -4.4806 -1.7990 -1.7990 -1.7935 -1.7935 0.3974 0.3974 0.4083 0.4083 0.6240 0.6240 0.6358 0.6358 1.4344 1.4344 1.4450 1.4450 2.2823 2.2823 2.2904 2.2904 3.0625 3.0625 3.0732 3.0732 3.8805 3.8805 3.8901 3.8901 4.2453 4.2453 4.2570 4.2570 4.8418 4.8418 4.8501 4.8501 7.0419 7.0419 7.0444 7.0444 7.7158 7.7158 7.7228 7.7228 8.1575 8.1575 8.1583 8.1583 k = 0.2188 0.4425 0.0364 ( 29734 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6903 -40.6903 -40.6895 -40.6895 -40.6673 -40.6673 -40.6672 -40.6672 -40.6651 -40.6651 -40.6651 -40.6651 -7.7833 -7.7833 -7.7825 -7.7825 -6.1089 -6.1089 -6.1067 -6.1067 -4.4190 -4.4190 -4.4189 -4.4189 -1.8729 -1.8729 -1.8674 -1.8674 0.3968 0.3968 0.4072 0.4072 0.6608 0.6608 0.6737 0.6737 1.3806 1.3806 1.3914 1.3914 2.3177 2.3177 2.3275 2.3275 3.0967 3.0967 3.1080 3.1080 3.8961 3.8961 3.9074 3.9074 4.2483 4.2483 4.2604 4.2604 4.8476 4.8476 4.8563 4.8563 7.0602 7.0602 7.0626 7.0626 7.7198 7.7198 7.7269 7.7269 8.1623 8.1623 8.1633 8.1633 k = 0.2344 0.4425 0.0364 ( 29734 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6903 -40.6903 -40.6895 -40.6895 -40.6672 -40.6672 -40.6672 -40.6672 -40.6652 -40.6652 -40.6651 -40.6651 -7.7589 -7.7589 -7.7580 -7.7580 -6.1681 -6.1681 -6.1659 -6.1659 -4.3569 -4.3569 -4.3568 -4.3568 -1.9475 -1.9475 -1.9421 -1.9421 0.3864 0.3864 0.3966 0.3966 0.7092 0.7092 0.7229 0.7229 1.3282 1.3282 1.3391 1.3391 2.3456 2.3456 2.3573 2.3573 3.1333 3.1333 3.1453 3.1453 3.9138 3.9138 3.9268 3.9268 4.2511 4.2511 4.2636 4.2636 4.8512 4.8512 4.8603 4.8603 7.0822 7.0822 7.0843 7.0843 7.7251 7.7251 7.7323 7.7323 8.1659 8.1659 8.1670 8.1670 k = 0.2500 0.4425 0.0364 ( 29736 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6902 -40.6902 -40.6894 -40.6894 -40.6672 -40.6672 -40.6672 -40.6672 -40.6652 -40.6652 -40.6652 -40.6652 -7.7330 -7.7330 -7.7320 -7.7320 -6.2270 -6.2270 -6.2249 -6.2249 -4.2945 -4.2945 -4.2943 -4.2943 -2.0226 -2.0226 -2.0174 -2.0174 0.3722 0.3722 0.3824 0.3824 0.7622 0.7622 0.7765 0.7765 1.2784 1.2784 1.2896 1.2896 2.3651 2.3651 2.3787 2.3787 3.1730 3.1730 3.1857 3.1857 3.9331 3.9331 3.9478 3.9478 4.2540 4.2540 4.2668 4.2668 4.8523 4.8523 4.8617 4.8617 7.1076 7.1076 7.1095 7.1095 7.7318 7.7318 7.7390 7.7390 8.1685 8.1685 8.1696 8.1696 k = 0.2656 0.4425 0.0364 ( 29726 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6902 -40.6902 -40.6894 -40.6894 -40.6672 -40.6672 -40.6671 -40.6671 -40.6653 -40.6653 -40.6653 -40.6653 -7.7055 -7.7055 -7.7045 -7.7045 -6.2857 -6.2857 -6.2835 -6.2835 -4.2317 -4.2317 -4.2313 -4.2313 -2.0980 -2.0980 -2.0930 -2.0930 0.3575 0.3575 0.3677 0.3677 0.8149 0.8149 0.8296 0.8296 1.2333 1.2333 1.2447 1.2447 2.3760 2.3760 2.3912 2.3912 3.2160 3.2160 3.2295 3.2295 3.9534 3.9534 3.9697 3.9697 4.2571 4.2571 4.2701 4.2701 4.8508 4.8508 4.8606 4.8606 7.1365 7.1365 7.1381 7.1381 7.7399 7.7399 7.7470 7.7470 8.1703 8.1703 8.1715 8.1715 k = 0.2812 0.4425 0.0364 ( 29726 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6671 -40.6671 -40.6671 -40.6671 -40.6654 -40.6654 -40.6653 -40.6653 -7.6765 -7.6765 -7.6755 -7.6755 -6.3439 -6.3439 -6.3418 -6.3418 -4.1685 -4.1685 -4.1680 -4.1680 -2.1738 -2.1738 -2.1689 -2.1689 0.3438 0.3438 0.3540 0.3540 0.8624 0.8624 0.8771 0.8771 1.1964 1.1964 1.2083 1.2083 2.3782 2.3782 2.3949 2.3949 3.2622 3.2622 3.2765 3.2765 3.9740 3.9740 3.9917 3.9917 4.2607 4.2607 4.2739 4.2739 4.8467 4.8467 4.8567 4.8567 7.1685 7.1685 7.1699 7.1699 7.7493 7.7493 7.7563 7.7563 8.1717 8.1717 8.1730 8.1730 k = 0.2969 0.4425 0.0364 ( 29732 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6671 -40.6671 -40.6671 -40.6671 -40.6654 -40.6654 -40.6654 -40.6654 -7.6461 -7.6461 -7.6450 -7.6450 -6.4018 -6.4018 -6.3996 -6.3996 -4.1048 -4.1048 -4.1042 -4.1042 -2.2496 -2.2496 -2.2449 -2.2449 0.3318 0.3318 0.3421 0.3421 0.8971 0.8971 0.9114 0.9114 1.1745 1.1745 1.1873 1.1873 2.3722 2.3722 2.3902 2.3902 3.3114 3.3114 3.3262 3.3262 3.9940 3.9940 4.0132 4.0132 4.2653 4.2653 4.2785 4.2785 4.8399 4.8399 4.8501 4.8501 7.2033 7.2033 7.2043 7.2043 7.7601 7.7601 7.7669 7.7669 8.1731 8.1731 8.1744 8.1744 k = 0.3125 0.4425 0.0364 ( 29744 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6670 -40.6670 -40.6670 -40.6670 -40.6655 -40.6655 -40.6655 -40.6655 -7.6142 -7.6142 -7.6131 -7.6131 -6.4592 -6.4592 -6.4570 -6.4570 -4.0407 -4.0407 -4.0399 -4.0399 -2.3255 -2.3255 -2.3209 -2.3209 0.3219 0.3219 0.3323 0.3323 0.9101 0.9101 0.9236 0.9236 1.1764 1.1764 1.1905 1.1905 2.3587 2.3587 2.3777 2.3777 3.3627 3.3627 3.3781 3.3781 4.0125 4.0125 4.0329 4.0329 4.2714 4.2714 4.2846 4.2846 4.8303 4.8303 4.8408 4.8408 7.2403 7.2403 7.2410 7.2410 7.7721 7.7721 7.7786 7.7786 8.1750 8.1750 8.1762 8.1762 k = 0.3281 0.4425 0.0364 ( 29726 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6670 -40.6670 -40.6670 -40.6670 -40.6655 -40.6655 -40.6655 -40.6655 -7.5809 -7.5809 -7.5797 -7.5797 -6.5160 -6.5160 -6.5139 -6.5139 -3.9761 -3.9761 -3.9752 -3.9752 -2.4012 -2.4012 -2.3968 -2.3968 0.3144 0.3144 0.3249 0.3249 0.8996 0.8996 0.9122 0.9122 1.2037 1.2037 1.2192 1.2192 2.3385 2.3385 2.3583 2.3583 3.4154 3.4154 3.4313 3.4313 4.0283 4.0283 4.0497 4.0497 4.2797 4.2797 4.2929 4.2929 4.8181 4.8181 4.8289 4.8289 7.2787 7.2787 7.2790 7.2790 7.7854 7.7854 7.7915 7.7915 8.1776 8.1776 8.1787 8.1787 k = 0.3438 0.4425 0.0364 ( 29706 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6669 -40.6669 -40.6669 -40.6669 -40.6656 -40.6656 -40.6656 -40.6656 -7.5463 -7.5463 -7.5451 -7.5451 -6.5722 -6.5722 -6.5701 -6.5701 -3.9111 -3.9111 -3.9100 -3.9100 -2.4768 -2.4768 -2.4726 -2.4726 0.3093 0.3093 0.3198 0.3198 0.8737 0.8737 0.8857 0.8857 1.2483 1.2483 1.2647 1.2647 2.3123 2.3123 2.3327 2.3327 3.4687 3.4687 3.4850 3.4850 4.0404 4.0404 4.0627 4.0627 4.2910 4.2910 4.3041 4.3041 4.8034 4.8034 4.8144 4.8144 7.3175 7.3175 7.3177 7.3177 7.7999 7.7999 7.8055 7.8055 8.1814 8.1814 8.1823 8.1823 k = 0.3594 0.4425 0.0364 ( 29694 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6669 -40.6669 -40.6669 -40.6669 -40.6657 -40.6657 -40.6656 -40.6656 -7.5105 -7.5105 -7.5092 -7.5092 -6.6276 -6.6276 -6.6255 -6.6255 -3.8455 -3.8455 -3.8443 -3.8443 -2.5521 -2.5521 -2.5481 -2.5481 0.3066 0.3066 0.3171 0.3171 0.8407 0.8407 0.8524 0.8524 1.3019 1.3019 1.3191 1.3191 2.2810 2.2810 2.3019 2.3019 3.5218 3.5218 3.5386 3.5386 4.0480 4.0480 4.0709 4.0709 4.3057 4.3057 4.3189 4.3189 4.7864 4.7864 4.7976 4.7976 7.3556 7.3556 7.3561 7.3561 7.8156 7.8156 7.8205 7.8205 8.1870 8.1870 8.1877 8.1877 k = 0.3750 0.4425 0.0364 ( 29708 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6668 -40.6668 -40.6668 -40.6668 -40.6657 -40.6657 -40.6657 -40.6657 -7.4735 -7.4735 -7.4721 -7.4721 -6.6823 -6.6823 -6.6802 -6.6802 -3.7795 -3.7795 -3.7782 -3.7782 -2.6271 -2.6271 -2.6232 -2.6232 0.3061 0.3061 0.3167 0.3167 0.8054 0.8054 0.8169 0.8169 1.3599 1.3599 1.3777 1.3777 2.2451 2.2451 2.2663 2.2663 3.5742 3.5742 3.5914 3.5914 4.0507 4.0507 4.0739 4.0739 4.3239 4.3239 4.3372 4.3372 4.7671 4.7671 4.7786 4.7786 7.3920 7.3920 7.3930 7.3930 7.8321 7.8321 7.8364 7.8364 8.1950 8.1950 8.1954 8.1954 k = 0.3906 0.4425 0.0364 ( 29694 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6668 -40.6668 -40.6668 -40.6668 -40.6658 -40.6658 -40.6658 -40.6658 -7.4354 -7.4354 -7.4340 -7.4340 -6.7359 -6.7359 -6.7339 -6.7339 -3.7131 -3.7131 -3.7116 -3.7116 -2.7016 -2.7016 -2.6979 -2.6979 0.3077 0.3077 0.3184 0.3184 0.7702 0.7702 0.7816 0.7816 1.4200 1.4200 1.4383 1.4383 2.2054 2.2054 2.2267 2.2267 3.6252 3.6252 3.6428 3.6428 4.0483 4.0483 4.0717 4.0717 4.3455 4.3455 4.3589 4.3589 4.7458 4.7458 4.7575 4.7575 7.4256 7.4256 7.4270 7.4270 7.8492 7.8492 7.8526 7.8526 8.2065 8.2065 8.2065 8.2065 k = 0.4062 0.4425 0.0364 ( 29694 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6667 -40.6667 -40.6667 -40.6667 -40.6659 -40.6659 -40.6658 -40.6658 -7.3965 -7.3965 -7.3950 -7.3950 -6.7884 -6.7884 -6.7864 -6.7864 -3.6463 -3.6463 -3.6446 -3.6446 -2.7755 -2.7755 -2.7720 -2.7720 0.3112 0.3112 0.3218 0.3218 0.7365 0.7365 0.7479 0.7479 1.4811 1.4811 1.4998 1.4998 2.1622 2.1622 2.1837 2.1837 3.6744 3.6744 3.6924 3.6924 4.0412 4.0412 4.0645 4.0645 4.3698 4.3698 4.3834 4.3834 4.7228 4.7228 4.7347 4.7347 7.4555 7.4555 7.4574 7.4574 7.8661 7.8661 7.8687 7.8687 8.2220 8.2220 8.2224 8.2224 k = 0.4219 0.4425 0.0364 ( 29704 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6667 -40.6667 -40.6667 -40.6667 -40.6659 -40.6659 -40.6659 -40.6659 -7.3569 -7.3569 -7.3554 -7.3554 -6.8394 -6.8394 -6.8374 -6.8374 -3.5792 -3.5792 -3.5774 -3.5774 -2.8487 -2.8487 -2.8454 -2.8454 0.3160 0.3160 0.3267 0.3267 0.7056 0.7056 0.7168 0.7168 1.5422 1.5422 1.5613 1.5613 2.1162 2.1162 2.1377 2.1377 3.7214 3.7214 3.7399 3.7399 4.0298 4.0298 4.0528 4.0528 4.3962 4.3962 4.4099 4.4099 4.6982 4.6982 4.7104 4.7104 7.4811 7.4811 7.4833 7.4833 7.8818 7.8818 7.8835 7.8835 8.2429 8.2429 8.2438 8.2438 k = 0.4375 0.4425 0.0364 ( 29714 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6666 -40.6666 -40.6660 -40.6660 -40.6660 -40.6660 -7.3173 -7.3173 -7.3158 -7.3158 -6.8884 -6.8884 -6.8865 -6.8865 -3.5121 -3.5121 -3.5101 -3.5101 -2.9208 -2.9208 -2.9177 -2.9177 0.3216 0.3216 0.3324 0.3324 0.6781 0.6781 0.6893 0.6893 1.6030 1.6030 1.6225 1.6225 2.0677 2.0677 2.0892 2.0892 3.7659 3.7659 3.7849 3.7849 4.0142 4.0142 4.0370 4.0370 4.4241 4.4241 4.4377 4.4377 4.6723 4.6723 4.6850 4.6850 7.5018 7.5018 7.5044 7.5044 7.8954 7.8954 7.8963 7.8963 8.2699 8.2699 8.2713 8.2713 k = 0.4531 0.4425 0.0364 ( 29722 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.2786 -7.2786 -7.2770 -7.2770 -6.9345 -6.9345 -6.9326 -6.9326 -3.4456 -3.4456 -3.4434 -3.4434 -2.9913 -2.9913 -2.9884 -2.9884 0.3275 0.3275 0.3382 0.3382 0.6552 0.6552 0.6664 0.6664 1.6628 1.6628 1.6826 1.6826 2.0175 2.0175 2.0388 2.0388 3.8077 3.8077 3.8271 3.8271 3.9950 3.9950 4.0173 4.0173 4.4526 4.4526 4.4660 4.4660 4.6457 4.6457 4.6588 4.6588 7.5177 7.5177 7.5206 7.5206 7.9061 7.9061 7.9065 7.9065 8.3032 8.3032 8.3049 8.3049 k = 0.4688 0.4425 0.0364 ( 29718 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.2428 -7.2428 -7.2411 -7.2411 -6.9756 -6.9756 -6.9736 -6.9736 -3.3811 -3.3811 -3.3787 -3.3787 -3.0587 -3.0587 -3.0559 -3.0559 0.3326 0.3326 0.3434 0.3434 0.6377 0.6377 0.6489 0.6489 1.7207 1.7207 1.7408 1.7408 1.9663 1.9663 1.9875 1.9875 3.8465 3.8465 3.8665 3.8665 3.9722 3.9722 3.9942 3.9942 4.4805 4.4805 4.4936 4.4936 4.6193 4.6193 4.6328 4.6328 7.5289 7.5289 7.5320 7.5320 7.9135 7.9135 7.9138 7.9138 8.3417 8.3417 8.3438 8.3438 k = 0.4844 0.4425 0.0364 ( 29736 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6665 -40.6665 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.2146 -7.2146 -7.2129 -7.2129 -7.0069 -7.0069 -7.0050 -7.0050 -3.3238 -3.3238 -3.3211 -3.3211 -3.1178 -3.1178 -3.1152 -3.1152 0.3362 0.3362 0.3470 0.3470 0.6267 0.6267 0.6379 0.6379 1.7736 1.7736 1.7940 1.7940 1.9174 1.9174 1.9385 1.9385 3.8820 3.8820 3.9024 3.9024 3.9463 3.9463 3.9679 3.9679 4.5053 4.5053 4.5178 4.5178 4.5955 4.5955 4.6096 4.6096 7.5355 7.5355 7.5387 7.5387 7.9178 7.9178 7.9182 7.9182 8.3836 8.3836 8.3862 8.3862 k = 0.5000 0.4425 0.0364 ( 29728 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6665 -40.6665 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.2031 -7.2031 -7.2013 -7.2013 -7.0195 -7.0195 -7.0176 -7.0176 -3.2951 -3.2951 -3.2923 -3.2923 -3.1470 -3.1470 -3.1446 -3.1446 0.3375 0.3375 0.3483 0.3483 0.6229 0.6229 0.6341 0.6341 1.8032 1.8032 1.8236 1.8236 1.8892 1.8892 1.9102 1.9102 3.9080 3.9080 3.9235 3.9235 3.9287 3.9287 3.9448 3.9448 4.5174 4.5174 4.5294 4.5294 4.5836 4.5836 4.5984 4.5984 7.5377 7.5377 7.5409 7.5409 7.9191 7.9191 7.9197 7.9197 8.4169 8.4169 8.4221 8.4221 k = 0.5000 0.4425 0.0364 ( 29728 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6665 -40.6665 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.2031 -7.2031 -7.2013 -7.2013 -7.0195 -7.0195 -7.0176 -7.0176 -3.2951 -3.2951 -3.2923 -3.2923 -3.1470 -3.1470 -3.1446 -3.1446 0.3375 0.3375 0.3483 0.3483 0.6229 0.6229 0.6341 0.6341 1.8032 1.8032 1.8236 1.8236 1.8892 1.8892 1.9102 1.9102 3.9080 3.9080 3.9235 3.9235 3.9287 3.9287 3.9448 3.9448 4.5174 4.5174 4.5294 4.5294 4.5836 4.5836 4.5984 4.5984 7.5377 7.5377 7.5409 7.5409 7.9191 7.9191 7.9197 7.9197 8.4169 8.4169 8.4221 8.4221 k = 0.5000 0.4437 0.0216 ( 29724 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6665 -40.6665 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.2029 -7.2029 -7.2012 -7.2012 -7.0197 -7.0197 -7.0178 -7.0178 -3.2974 -3.2974 -3.2947 -3.2947 -3.1442 -3.1442 -3.1419 -3.1419 0.3339 0.3339 0.3444 0.3444 0.6282 0.6282 0.6390 0.6390 1.7794 1.7794 1.7917 1.7917 1.9205 1.9205 1.9335 1.9335 3.8859 3.8859 3.8909 3.8909 3.9528 3.9528 3.9586 3.9586 4.5165 4.5165 4.5256 4.5256 4.5975 4.5975 4.6094 4.6094 7.5349 7.5349 7.5381 7.5381 7.9140 7.9140 7.9146 7.9146 8.4100 8.4100 8.4137 8.4137 k = 0.5000 0.4449 0.0068 ( 29722 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6665 -40.6665 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.2024 -7.2024 -7.2006 -7.2006 -7.0203 -7.0203 -7.0184 -7.0184 -3.3039 -3.3039 -3.3014 -3.3014 -3.1364 -3.1364 -3.1344 -3.1344 0.3240 0.3240 0.3335 0.3335 0.6430 0.6430 0.6529 0.6529 1.7328 1.7328 1.7400 1.7400 1.9705 1.9705 1.9783 1.9783 3.8448 3.8448 3.8478 3.8478 3.9713 3.9713 3.9753 3.9753 4.5171 4.5171 4.5221 4.5221 4.6303 4.6303 4.6383 4.6383 7.5265 7.5265 7.5296 7.5296 7.8993 7.8993 7.9004 7.9004 8.4036 8.4036 8.4061 8.4061 k = 0.5000 0.4461-0.0080 ( 29714 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6665 -40.6665 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.2015 -7.2015 -7.1998 -7.1998 -7.0213 -7.0213 -7.0194 -7.0194 -3.3133 -3.3133 -3.3112 -3.3112 -3.1249 -3.1249 -3.1231 -3.1231 0.3092 0.3092 0.3176 0.3176 0.6653 0.6653 0.6741 0.6741 1.6809 1.6809 1.6859 1.6859 2.0217 2.0217 2.0273 2.0273 3.7956 3.7956 3.7979 3.7979 3.9830 3.9830 3.9866 3.9866 4.5225 4.5225 4.5248 4.5248 4.6737 4.6737 4.6792 4.6792 7.5124 7.5124 7.5153 7.5153 7.8777 7.8777 7.8792 7.8792 8.4030 8.4030 8.4046 8.4046 k = 0.5000 0.4474-0.0228 ( 29718 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6665 -40.6665 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.2003 -7.2003 -7.1986 -7.1986 -7.0226 -7.0226 -7.0207 -7.0207 -3.3246 -3.3246 -3.3227 -3.3227 -3.1109 -3.1109 -3.1093 -3.1093 0.2915 0.2915 0.2988 0.2988 0.6931 0.6931 0.7009 0.7009 1.6280 1.6280 1.6318 1.6318 2.0717 2.0717 2.0761 2.0761 3.7410 3.7410 3.7429 3.7429 3.9893 3.9893 3.9927 3.9927 4.5337 4.5337 4.5342 4.5342 4.7239 4.7239 4.7278 4.7278 7.4926 7.4926 7.4952 7.4952 7.8520 7.8520 7.8540 7.8540 8.4076 8.4076 8.4086 8.4086 k = 0.5000 0.4486-0.0376 ( 29730 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6665 -40.6665 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.1988 -7.1988 -7.1971 -7.1971 -7.0243 -7.0243 -7.0225 -7.0225 -3.3367 -3.3367 -3.3351 -3.3351 -3.0954 -3.0954 -3.0941 -3.0941 0.2723 0.2723 0.2785 0.2785 0.7247 0.7247 0.7314 0.7314 1.5755 1.5755 1.5786 1.5786 2.1199 2.1199 2.1235 2.1235 3.6829 3.6829 3.6845 3.6845 3.9916 3.9916 3.9950 3.9950 4.5496 4.5496 4.5502 4.5502 4.7783 4.7783 4.7813 4.7813 7.4672 7.4672 7.4695 7.4695 7.8249 7.8249 7.8273 7.8273 8.4165 8.4165 8.4171 8.4171 k = 0.5000 0.4498-0.0524 ( 29738 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.1970 -7.1970 -7.1954 -7.1954 -7.0263 -7.0263 -7.0245 -7.0245 -3.3492 -3.3492 -3.3478 -3.3478 -3.0792 -3.0792 -3.0781 -3.0781 0.2526 0.2526 0.2580 0.2580 0.7587 0.7587 0.7646 0.7646 1.5241 1.5241 1.5267 1.5267 2.1655 2.1655 2.1686 2.1686 3.6229 3.6229 3.6243 3.6243 3.9913 3.9913 3.9945 3.9945 4.5697 4.5697 4.5709 4.5709 4.8352 4.8352 4.8374 4.8374 7.4364 7.4364 7.4384 7.4384 7.7983 7.7983 7.8010 7.8010 8.4289 8.4289 8.4292 8.4292 k = 0.5000 0.4510-0.0672 ( 29732 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.1950 -7.1950 -7.1934 -7.1934 -7.0285 -7.0285 -7.0268 -7.0268 -3.3614 -3.3614 -3.3602 -3.3602 -3.0628 -3.0628 -3.0619 -3.0619 0.2332 0.2332 0.2378 0.2378 0.7942 0.7942 0.7995 0.7995 1.4745 1.4745 1.4768 1.4768 2.2083 2.2083 2.2109 2.2109 3.5623 3.5623 3.5636 3.5636 3.9891 3.9891 3.9922 3.9922 4.5934 4.5934 4.5950 4.5950 4.8928 4.8928 4.8946 4.8946 7.4010 7.4010 7.4028 7.4028 7.7737 7.7737 7.7765 7.7765 8.4438 8.4438 8.4441 8.4441 k = 0.5000 0.4522-0.0820 ( 29720 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.1928 -7.1928 -7.1913 -7.1913 -7.0310 -7.0310 -7.0293 -7.0293 -3.3732 -3.3732 -3.3722 -3.3722 -3.0466 -3.0466 -3.0458 -3.0458 0.2146 0.2146 0.2186 0.2186 0.8306 0.8306 0.8352 0.8352 1.4272 1.4272 1.4292 1.4292 2.2478 2.2478 2.2502 2.2502 3.5025 3.5025 3.5036 3.5036 3.9859 3.9859 3.9888 3.9888 4.6197 4.6197 4.6214 4.6214 4.9500 4.9500 4.9515 4.9515 7.3620 7.3620 7.3635 7.3635 7.7516 7.7516 7.7544 7.7544 8.4609 8.4609 8.4611 8.4611 k = 0.5000 0.4535-0.0968 ( 29720 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.1904 -7.1904 -7.1889 -7.1889 -7.0336 -7.0336 -7.0320 -7.0320 -3.3843 -3.3843 -3.3834 -3.3834 -3.0310 -3.0310 -3.0303 -3.0303 0.1971 0.1971 0.2005 0.2005 0.8671 0.8671 0.8712 0.8712 1.3825 1.3825 1.3843 1.3843 2.2838 2.2838 2.2859 2.2859 3.4444 3.4444 3.4453 3.4453 3.9822 3.9822 3.9848 3.9848 4.6474 4.6474 4.6492 4.6492 5.0056 5.0056 5.0069 5.0069 7.3206 7.3206 7.3219 7.3219 7.7323 7.7323 7.7350 7.7350 8.4796 8.4796 8.4798 8.4798 k = 0.5000 0.4547-0.1116 ( 29724 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.1879 -7.1879 -7.1865 -7.1865 -7.0363 -7.0363 -7.0348 -7.0348 -3.3944 -3.3944 -3.3937 -3.3937 -3.0162 -3.0162 -3.0156 -3.0156 0.1810 0.1810 0.1839 0.1839 0.9031 0.9031 0.9068 0.9068 1.3408 1.3408 1.3425 1.3425 2.3161 2.3161 2.3178 2.3178 3.3889 3.3889 3.3898 3.3898 3.9783 3.9783 3.9807 3.9807 4.6756 4.6756 4.6774 4.6774 5.0589 5.0589 5.0599 5.0599 7.2783 7.2783 7.2794 7.2794 7.7156 7.7156 7.7181 7.7181 8.4993 8.4993 8.4996 8.4996 k = 0.5000 0.4559-0.1264 ( 29748 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6661 -40.6661 -7.1854 -7.1854 -7.1841 -7.1841 -7.0390 -7.0390 -7.0377 -7.0377 -3.4036 -3.4036 -3.4030 -3.4030 -3.0024 -3.0024 -3.0020 -3.0020 0.1664 0.1664 0.1688 0.1688 0.9382 0.9382 0.9414 0.9414 1.3025 1.3025 1.3041 1.3041 2.3443 2.3443 2.3458 2.3458 3.3371 3.3371 3.3378 3.3378 3.9745 3.9745 3.9766 3.9766 4.7033 4.7033 4.7049 4.7049 5.1089 5.1089 5.1097 5.1097 7.2365 7.2365 7.2374 7.2374 7.7014 7.7014 7.7037 7.7037 8.5195 8.5195 8.5199 8.5199 k = 0.5000 0.4571-0.1412 ( 29750 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1830 -7.1830 -7.1818 -7.1818 -7.0417 -7.0417 -7.0404 -7.0404 -3.4118 -3.4118 -3.4112 -3.4112 -2.9900 -2.9900 -2.9897 -2.9897 0.1535 0.1535 0.1555 0.1555 0.9715 0.9715 0.9744 0.9744 1.2681 1.2681 1.2695 1.2695 2.3684 2.3684 2.3697 2.3697 3.2896 3.2896 3.2902 3.2902 3.9710 3.9710 3.9729 3.9729 4.7295 4.7295 4.7309 4.7309 5.1549 5.1549 5.1556 5.1556 7.1967 7.1967 7.1973 7.1973 7.6895 7.6895 7.6915 7.6915 8.5398 8.5398 8.5403 8.5403 k = 0.5000 0.4583-0.1560 ( 29738 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1806 -7.1806 -7.1795 -7.1795 -7.0442 -7.0442 -7.0431 -7.0431 -3.4188 -3.4188 -3.4183 -3.4183 -2.9791 -2.9791 -2.9788 -2.9788 0.1423 0.1423 0.1439 0.1439 1.0026 1.0026 1.0049 1.0049 1.2379 1.2379 1.2390 1.2390 2.3883 2.3883 2.3893 2.3893 3.2472 3.2472 3.2478 3.2478 3.9680 3.9680 3.9697 3.9697 4.7531 4.7531 4.7544 4.7544 5.1964 5.1964 5.1969 5.1969 7.1602 7.1602 7.1606 7.1606 7.6798 7.6798 7.6814 7.6814 8.5594 8.5594 8.5601 8.5601 k = 0.5000 0.4595-0.1708 ( 29734 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1785 -7.1785 -7.1775 -7.1775 -7.0464 -7.0464 -7.0455 -7.0455 -3.4245 -3.4245 -3.4242 -3.4242 -2.9698 -2.9698 -2.9696 -2.9696 0.1329 0.1329 0.1341 0.1341 1.0303 1.0303 1.0320 1.0320 1.2127 1.2127 1.2133 1.2133 2.4040 2.4040 2.4046 2.4046 3.2106 3.2106 3.2111 3.2111 3.9656 3.9656 3.9670 3.9670 4.7734 4.7734 4.7744 4.7744 5.2326 5.2326 5.2330 5.2330 7.1283 7.1283 7.1285 7.1285 7.6719 7.6719 7.6732 7.6732 8.5777 8.5777 8.5785 8.5785 k = 0.5000 0.4608-0.1856 ( 29748 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1766 -7.1766 -7.1759 -7.1759 -7.0483 -7.0483 -7.0475 -7.0475 -3.4291 -3.4291 -3.4289 -3.4289 -2.9623 -2.9623 -2.9622 -2.9622 0.1254 0.1254 0.1263 0.1263 1.0534 1.0534 1.0541 1.0541 1.1934 1.1934 1.1935 1.1935 2.4154 2.4154 2.4158 2.4158 3.1803 3.1803 3.1808 3.1808 3.9639 3.9639 3.9651 3.9651 4.7893 4.7893 4.7902 4.7902 5.2630 5.2630 5.2633 5.2633 7.1022 7.1022 7.1024 7.1024 7.6658 7.6658 7.6667 7.6667 8.5937 8.5937 8.5947 8.5947 k = 0.5000 0.4620-0.2004 ( 29748 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1752 -7.1752 -7.1746 -7.1746 -7.0498 -7.0498 -7.0492 -7.0492 -3.4324 -3.4324 -3.4322 -3.4322 -2.9568 -2.9568 -2.9567 -2.9567 0.1197 0.1197 0.1203 0.1203 1.0690 1.0690 1.0697 1.0697 1.1810 1.1810 1.1824 1.1824 2.4228 2.4228 2.4229 2.4229 3.1568 3.1568 3.1574 3.1574 3.9629 3.9629 3.9639 3.9639 4.8003 4.8003 4.8009 4.8009 5.2870 5.2870 5.2873 5.2873 7.0828 7.0828 7.0831 7.0831 7.6614 7.6614 7.6619 7.6619 8.6067 8.6067 8.6078 8.6078 k = 0.5000 0.4620-0.2004 ( 29748 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1752 -7.1752 -7.1746 -7.1746 -7.0498 -7.0498 -7.0492 -7.0492 -3.4324 -3.4324 -3.4322 -3.4322 -2.9568 -2.9568 -2.9567 -2.9567 0.1197 0.1197 0.1203 0.1203 1.0690 1.0690 1.0697 1.0697 1.1810 1.1810 1.1824 1.1824 2.4228 2.4228 2.4229 2.4229 3.1568 3.1568 3.1574 3.1574 3.9629 3.9629 3.9639 3.9639 4.8003 4.8003 4.8009 4.8009 5.2870 5.2870 5.2873 5.2873 7.0828 7.0828 7.0831 7.0831 7.6614 7.6614 7.6619 7.6619 8.6067 8.6067 8.6078 8.6078 k = 0.5000 0.4555-0.2125 ( 29752 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1743 -7.1743 -7.1738 -7.1738 -7.0504 -7.0504 -7.0499 -7.0499 -3.4349 -3.4349 -3.4348 -3.4348 -2.9542 -2.9542 -2.9541 -2.9541 0.1153 0.1153 0.1157 0.1157 1.0800 1.0800 1.0806 1.0806 1.1740 1.1740 1.1751 1.1751 2.4262 2.4262 2.4263 2.4263 3.1405 3.1405 3.1409 3.1409 3.9696 3.9696 3.9703 3.9703 4.8080 4.8080 4.8084 4.8084 5.3033 5.3033 5.3036 5.3036 7.0700 7.0700 7.0703 7.0703 7.6533 7.6533 7.6536 7.6536 8.6160 8.6160 8.6168 8.6168 k = 0.5000 0.4490-0.2246 ( 29750 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1738 -7.1738 -7.1733 -7.1733 -7.0508 -7.0508 -7.0503 -7.0503 -3.4364 -3.4364 -3.4363 -3.4363 -2.9526 -2.9526 -2.9526 -2.9526 0.1127 0.1127 0.1129 0.1129 1.0869 1.0869 1.0873 1.0873 1.1698 1.1698 1.1704 1.1704 2.4282 2.4282 2.4283 2.4283 3.1307 3.1307 3.1309 3.1309 3.9737 3.9737 3.9741 3.9741 4.8126 4.8126 4.8128 4.8128 5.3133 5.3133 5.3136 5.3136 7.0622 7.0622 7.0624 7.0624 7.6485 7.6485 7.6486 7.6486 8.6216 8.6216 8.6220 8.6220 k = 0.5000 0.4425-0.2368 ( 29744 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1736 -7.1736 -7.1731 -7.1731 -7.0509 -7.0509 -7.0504 -7.0504 -3.4369 -3.4369 -3.4368 -3.4368 -2.9521 -2.9521 -2.9521 -2.9521 0.1119 0.1119 0.1119 0.1119 1.0894 1.0894 1.0895 1.0895 1.1686 1.1686 1.1686 1.1686 2.4288 2.4288 2.4289 2.4289 3.1274 3.1274 3.1276 3.1276 3.9752 3.9752 3.9753 3.9753 4.8142 4.8142 4.8143 4.8143 5.3166 5.3166 5.3169 5.3169 7.0596 7.0596 7.0598 7.0598 7.6469 7.6469 7.6469 7.6469 8.6235 8.6235 8.6236 8.6236 k = 0.5000 0.4425-0.2368 ( 29744 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1736 -7.1736 -7.1731 -7.1731 -7.0509 -7.0509 -7.0504 -7.0504 -3.4369 -3.4369 -3.4368 -3.4368 -2.9521 -2.9521 -2.9521 -2.9521 0.1119 0.1119 0.1119 0.1119 1.0894 1.0894 1.0895 1.0895 1.1686 1.1686 1.1686 1.1686 2.4288 2.4288 2.4289 2.4289 3.1274 3.1274 3.1276 3.1276 3.9752 3.9752 3.9753 3.9753 4.8142 4.8142 4.8143 4.8143 5.3166 5.3166 5.3169 5.3169 7.0596 7.0596 7.0598 7.0598 7.6469 7.6469 7.6469 7.6469 8.6235 8.6235 8.6236 8.6236 k = 0.4844 0.4425-0.2368 ( 29746 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.2181 -7.2181 -7.1277 -7.1277 -7.1021 -7.1021 -6.9980 -6.9980 -3.5134 -3.5134 -3.3594 -3.3594 -3.0171 -3.0171 -2.8870 -2.8870 0.0872 0.0872 0.1394 0.1394 1.0652 1.0652 1.0906 1.0906 1.1348 1.1348 1.2271 1.2271 2.3808 2.3808 2.4738 2.4738 3.1266 3.1266 3.1293 3.1293 3.9641 3.9641 3.9815 3.9815 4.7965 4.7965 4.8301 4.8301 5.2674 5.2674 5.3630 5.3630 7.0552 7.0552 7.0652 7.0652 7.6286 7.6286 7.6686 7.6686 8.5866 8.5866 8.6565 8.6565 k = 0.4688 0.4425-0.2368 ( 29754 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6667 -40.6667 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.2618 -7.2618 -7.1523 -7.1523 -7.0812 -7.0812 -6.9442 -6.9442 -3.5889 -3.5889 -3.2810 -3.2810 -3.0822 -3.0822 -2.8218 -2.8218 0.0652 0.0652 0.1695 0.1695 1.0378 1.0378 1.0407 1.0407 1.1562 1.1562 1.2873 1.2873 2.3302 2.3302 2.5147 2.5147 3.1264 3.1264 3.1324 3.1324 3.9484 3.9484 3.9829 3.9829 4.7772 4.7772 4.8440 4.8440 5.2159 5.2159 5.4047 5.4047 7.0508 7.0508 7.0728 7.0728 7.6136 7.6136 7.6933 7.6933 8.5449 8.5449 8.6864 8.6864 k = 0.4531 0.4425-0.2368 ( 29744 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6667 -40.6667 -40.6665 -40.6665 -40.6661 -40.6661 -40.6659 -40.6659 -7.3045 -7.3045 -7.2012 -7.2012 -7.0339 -7.0339 -6.8893 -6.8893 -3.6635 -3.6635 -3.2016 -3.2016 -3.1471 -3.1471 -2.7566 -2.7566 0.0461 0.0461 0.2022 0.2022 0.9788 0.9788 1.0173 1.0173 1.1854 1.1854 1.3475 1.3475 2.2776 2.2776 2.5506 2.5506 3.1266 3.1266 3.1375 3.1375 3.9281 3.9281 3.9793 3.9793 4.7567 4.7567 4.8557 4.8557 5.1636 5.1636 5.4409 5.4409 7.0456 7.0456 7.0837 7.0837 7.6021 7.6021 7.7210 7.7210 8.4981 8.4981 8.7141 8.7141 k = 0.4375 0.4425-0.2368 ( 29758 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6668 -40.6668 -40.6665 -40.6665 -40.6661 -40.6661 -40.6659 -40.6659 -7.3462 -7.3462 -7.2489 -7.2489 -6.9858 -6.9858 -6.8333 -6.8333 -3.7371 -3.7371 -3.2120 -3.2120 -3.1215 -3.1215 -2.6915 -2.6915 0.0300 0.0300 0.2374 0.2374 0.9193 0.9193 0.9957 0.9957 1.2163 1.2163 1.4072 1.4072 2.2238 2.2238 2.5804 2.5804 3.1272 3.1272 3.1454 3.1454 3.9036 3.9036 3.9707 3.9707 4.7352 4.7352 4.8650 4.8650 5.1115 5.1115 5.4704 5.4704 7.0390 7.0390 7.0991 7.0991 7.5936 7.5936 7.7513 7.7513 8.4461 8.4461 8.7403 8.7403 k = 0.4219 0.4425-0.2368 ( 29748 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6668 -40.6668 -40.6665 -40.6665 -40.6660 -40.6660 -40.6658 -40.6658 -7.3868 -7.3868 -7.2951 -7.2951 -6.9369 -6.9369 -6.7762 -6.7762 -3.8097 -3.8097 -3.2768 -3.2768 -3.0405 -3.0405 -2.6263 -2.6263 0.0168 0.0168 0.2749 0.2749 0.8604 0.8604 0.9759 0.9759 1.2477 1.2477 1.4659 1.4659 2.1690 2.1690 2.6029 2.6029 3.1280 3.1280 3.1570 3.1570 3.8749 3.8749 3.9572 3.9572 4.7131 4.7131 4.8718 4.8718 5.0605 5.0605 5.4926 5.4926 7.0308 7.0308 7.1198 7.1198 7.5879 7.5879 7.7838 7.7838 8.3896 8.3896 8.7653 8.7653 k = 0.4062 0.4425-0.2368 ( 29738 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6669 -40.6669 -40.6666 -40.6666 -40.6659 -40.6659 -40.6658 -40.6658 -7.4263 -7.4263 -7.3400 -7.3400 -6.8874 -6.8874 -6.7182 -6.7182 -3.8814 -3.8814 -3.3415 -3.3415 -2.9588 -2.9588 -2.5611 -2.5611 0.0066 0.0066 0.3145 0.3145 0.8023 0.8023 0.9581 0.9581 1.2788 1.2788 1.5233 1.5233 2.1141 2.1141 2.6170 2.6170 3.1292 3.1292 3.1729 3.1729 3.8422 3.8422 3.9392 3.9392 4.6907 4.6907 4.8761 4.8761 5.0113 5.0113 5.5067 5.5067 7.0207 7.0207 7.1466 7.1466 7.5843 7.5843 7.8182 7.8182 8.3295 8.3295 8.7891 8.7891 k = 0.3906 0.4425-0.2368 ( 29750 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6669 -40.6669 -40.6666 -40.6666 -40.6659 -40.6659 -40.6657 -40.6657 -7.4645 -7.4645 -7.3834 -7.3834 -6.8373 -6.8373 -6.6593 -6.6593 -3.9521 -3.9521 -3.4061 -3.4061 -2.8764 -2.8764 -2.4959 -2.4959 -0.0004 -0.0004 0.3559 0.3559 0.7455 0.7455 0.9424 0.9424 1.3088 1.3088 1.5789 1.5789 2.0599 2.0599 2.6220 2.6220 3.1307 3.1307 3.1935 3.1935 3.8056 3.8056 3.9174 3.9174 4.6683 4.6683 4.8778 4.8778 4.9646 4.9646 5.5126 5.5126 7.0090 7.0090 7.1798 7.1798 7.5823 7.5823 7.8542 7.8542 8.2667 8.2667 8.7700 8.7700 k = 0.3750 0.4425-0.2368 ( 29744 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6670 -40.6670 -40.6667 -40.6667 -40.6658 -40.6658 -40.6657 -40.6657 -7.5016 -7.5016 -7.4254 -7.4254 -6.7865 -6.7865 -6.5995 -6.5995 -4.0218 -4.0218 -3.4706 -3.4706 -2.7935 -2.7935 -2.4306 -2.4306 -0.0043 -0.0043 0.3983 0.3983 0.6908 0.6908 0.9288 0.9288 1.3365 1.3365 1.6323 1.6323 2.0075 2.0075 2.6178 2.6178 3.1327 3.1327 3.2186 3.2186 3.7654 3.7654 3.8924 3.8924 4.6462 4.6462 4.8769 4.8769 4.9208 4.9208 5.5104 5.5104 6.9957 6.9957 7.2197 7.2197 7.5811 7.5811 7.8912 7.8912 8.2025 8.2025 8.7190 8.7190 k = 0.3594 0.4425-0.2368 ( 29730 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6670 -40.6670 -40.6667 -40.6667 -40.6657 -40.6657 -40.6656 -40.6656 -7.5374 -7.5374 -7.4659 -7.4659 -6.7352 -6.7352 -6.5389 -6.5389 -4.0906 -4.0906 -3.5351 -3.5351 -2.7102 -2.7102 -2.3653 -2.3653 -0.0051 -0.0051 0.4397 0.4397 0.6403 0.6403 0.9173 0.9173 1.3599 1.3599 1.6828 1.6828 1.9588 1.9588 2.6045 2.6045 3.1351 3.1351 3.2475 3.2475 3.7217 3.7217 3.8656 3.8656 4.6245 4.6245 4.8734 4.8734 4.8802 4.8802 5.5004 5.5004 6.9811 6.9811 7.2658 7.2658 7.5801 7.5801 7.9286 7.9286 8.1378 8.1378 8.6680 8.6680 k = 0.3438 0.4425-0.2368 ( 29748 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6671 -40.6671 -40.6668 -40.6668 -40.6656 -40.6656 -40.6656 -40.6656 -7.5719 -7.5719 -7.5049 -7.5049 -6.6835 -6.6835 -6.4774 -6.4774 -4.1585 -4.1585 -3.5995 -3.5995 -2.6267 -2.6267 -2.2998 -2.2998 -0.0026 -0.0026 0.4723 0.4723 0.6016 0.6016 0.9082 0.9082 1.3765 1.3765 1.7298 1.7298 1.9162 1.9162 2.5827 2.5827 3.1381 3.1381 3.2794 3.2794 3.6746 3.6746 3.8382 3.8382 4.6033 4.6033 4.8424 4.8424 4.8679 4.8679 5.4834 5.4834 6.9655 6.9655 7.3180 7.3180 7.5784 7.5784 7.9655 7.9655 8.0734 8.0734 8.6179 8.6179 k = 0.3281 0.4425-0.2368 ( 29732 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6671 -40.6671 -40.6668 -40.6668 -40.6656 -40.6656 -40.6655 -40.6655 -7.6051 -7.6051 -7.5424 -7.5424 -6.6313 -6.6313 -6.4153 -6.4153 -4.2255 -4.2255 -3.6638 -3.6638 -2.5433 -2.5433 -2.2340 -2.2340 0.0031 0.0031 0.4727 0.4727 0.5983 0.5983 0.9012 0.9012 1.3828 1.3828 1.7728 1.7728 1.8832 1.8832 2.5530 2.5530 3.1417 3.1417 3.3129 3.3129 3.6244 3.6244 3.8122 3.8122 4.5827 4.5827 4.8081 4.8081 4.8597 4.8597 5.4599 5.4599 6.9491 6.9491 7.3754 7.3754 7.5755 7.5755 8.0006 8.0006 8.0100 8.0100 8.5694 8.5694 k = 0.3125 0.4425-0.2368 ( 29726 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6672 -40.6672 -40.6669 -40.6669 -40.6655 -40.6655 -40.6654 -40.6654 -7.6370 -7.6370 -7.5783 -7.5783 -6.5786 -6.5786 -6.3525 -6.3525 -4.2916 -4.2916 -3.7280 -3.7280 -2.4602 -2.4602 -2.1677 -2.1677 0.0121 0.0121 0.4380 0.4380 0.6332 0.6332 0.8965 0.8965 1.3755 1.3755 1.8108 1.8108 1.8630 1.8630 2.5162 2.5162 3.1460 3.1460 3.3466 3.3466 3.5711 3.5711 3.7896 3.7896 4.5628 4.5628 4.7768 4.7768 4.8494 4.8494 5.4309 5.4309 6.9320 6.9320 7.4375 7.4375 7.5708 7.5708 7.9475 7.9475 8.0322 8.0322 8.5231 8.5231 k = 0.2969 0.4425-0.2368 ( 29714 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6672 -40.6672 -40.6669 -40.6669 -40.6654 -40.6654 -40.6654 -40.6654 -7.6674 -7.6674 -7.6126 -7.6126 -6.5257 -6.5257 -6.2891 -6.2891 -4.3568 -4.3568 -3.7923 -3.7923 -2.3780 -2.3780 -2.1007 -2.1007 0.0244 0.0244 0.3922 0.3922 0.6822 0.6822 0.8941 0.8941 1.3525 1.3525 1.8429 1.8429 1.8579 1.8579 2.4730 2.4730 3.1507 3.1507 3.3789 3.3789 3.5152 3.5152 3.7725 3.7725 4.5435 4.5435 4.7484 4.7484 4.8371 4.8371 5.3973 5.3973 6.9144 6.9144 7.5034 7.5034 7.5639 7.5639 7.8864 7.8864 8.0562 8.0562 8.4796 8.4796 k = 0.2812 0.4425-0.2368 ( 29700 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6902 -40.6902 -40.6894 -40.6894 -40.6673 -40.6673 -40.6669 -40.6669 -40.6654 -40.6654 -40.6653 -40.6653 -7.6965 -7.6965 -7.6453 -7.6453 -6.4724 -6.4724 -6.2251 -6.2251 -4.4212 -4.4212 -3.8564 -3.8564 -2.2971 -2.2971 -2.0326 -2.0326 0.0400 0.0400 0.3439 0.3439 0.7366 0.7366 0.8940 0.8940 1.3148 1.3148 1.8643 1.8643 1.8709 1.8709 2.4243 2.4243 3.1560 3.1560 3.4081 3.4081 3.4568 3.4568 3.7633 3.7633 4.5248 4.5248 4.7226 4.7226 4.8229 4.8229 5.3599 5.3599 6.8964 6.8964 7.5531 7.5531 7.5737 7.5737 7.8265 7.8265 8.0677 8.0677 8.4397 8.4397 k = 0.2656 0.4425-0.2368 ( 29700 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6902 -40.6902 -40.6894 -40.6894 -40.6673 -40.6673 -40.6670 -40.6670 -40.6653 -40.6653 -40.6653 -40.6653 -7.7241 -7.7241 -7.6764 -7.6764 -6.4188 -6.4188 -6.1606 -6.1606 -4.4848 -4.4848 -3.9206 -3.9206 -2.2181 -2.2181 -1.9630 -1.9630 0.0588 0.0588 0.2956 0.2956 0.7938 0.7938 0.8960 0.8960 1.2650 1.2650 1.8834 1.8834 1.8903 1.8903 2.3709 2.3709 3.1614 3.1614 3.3957 3.3957 3.4338 3.4338 3.7638 3.7638 4.5068 4.5068 4.6992 4.6992 4.8071 4.8071 5.3194 5.3194 6.8779 6.8779 7.5413 7.5413 7.6446 7.6446 7.7680 7.7680 8.0608 8.0608 8.4041 8.4041 k = 0.2500 0.4425-0.2368 ( 29690 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6902 -40.6902 -40.6894 -40.6894 -40.6673 -40.6673 -40.6670 -40.6670 -40.6653 -40.6653 -40.6652 -40.6652 -7.7502 -7.7502 -7.7059 -7.7059 -6.3650 -6.3650 -6.0957 -6.0957 -4.5477 -4.5477 -3.9848 -3.9848 -2.1418 -2.1418 -1.8914 -1.8914 0.0810 0.0810 0.2479 0.2479 0.8524 0.8524 0.9003 0.9003 1.2069 1.2069 1.8985 1.8985 1.9140 1.9140 2.3135 2.3135 3.1662 3.1662 3.3342 3.3342 3.4542 3.4542 3.7749 3.7749 4.4894 4.4894 4.6781 4.6781 4.7900 4.7900 5.2768 5.2768 6.8590 6.8590 7.5259 7.5259 7.7107 7.7107 7.7179 7.7179 8.0337 8.0337 8.3729 8.3729 k = 0.2344 0.4425-0.2368 ( 29706 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6903 -40.6903 -40.6895 -40.6895 -40.6674 -40.6674 -40.6670 -40.6670 -40.6652 -40.6652 -40.6651 -40.6651 -7.7748 -7.7748 -7.7336 -7.7336 -6.3110 -6.3110 -6.0303 -6.0303 -4.6097 -4.6097 -4.0490 -4.0490 -2.0688 -2.0688 -1.8174 -1.8174 0.1065 0.1065 0.2013 0.2013 0.9053 0.9053 0.9114 0.9114 1.1448 1.1448 1.9017 1.9017 1.9465 1.9465 2.2534 2.2534 3.1679 3.1679 3.2740 3.2740 3.4710 3.4710 3.7959 3.7959 4.4726 4.4726 4.6590 4.6590 4.7718 4.7718 5.2325 5.2325 6.8393 6.8393 7.5073 7.5073 7.6552 7.6552 7.7921 7.7921 7.9910 7.9910 8.3464 8.3464 k = 0.2188 0.4425-0.2368 ( 29700 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6903 -40.6903 -40.6895 -40.6895 -40.6674 -40.6674 -40.6671 -40.6671 -40.6652 -40.6652 -40.6651 -40.6651 -7.7980 -7.7980 -7.7597 -7.7597 -6.2568 -6.2568 -5.9647 -5.9647 -4.6711 -4.6711 -4.1132 -4.1132 -1.9996 -1.9996 -1.7407 -1.7407 0.1352 0.1352 0.1561 0.1561 0.9144 0.9144 0.9576 0.9576 1.0901 1.0901 1.8957 1.8957 1.9829 1.9829 2.1916 2.1916 3.1544 3.1544 3.2273 3.2273 3.4857 3.4857 3.8251 3.8251 4.4566 4.4566 4.6416 4.6416 4.7530 4.7530 5.1872 5.1872 6.8187 6.8187 7.4854 7.4854 7.6024 7.6024 7.8658 7.8658 7.9402 7.9402 8.3248 8.3248 k = 0.2031 0.4425-0.2368 ( 29700 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6903 -40.6903 -40.6895 -40.6895 -40.6674 -40.6674 -40.6671 -40.6671 -40.6651 -40.6651 -40.6650 -40.6650 -7.8196 -7.8196 -7.7841 -7.7841 -6.2025 -6.2025 -5.8988 -5.8988 -4.7318 -4.7318 -4.1775 -4.1775 -1.9347 -1.9347 -1.6615 -1.6615 0.1123 0.1123 0.1673 0.1673 0.9242 0.9242 0.9502 0.9502 1.0881 1.0881 1.8802 1.8802 2.0212 2.0212 2.1297 2.1297 3.1066 3.1066 3.2134 3.2134 3.4999 3.4999 3.8602 3.8602 4.4412 4.4412 4.6259 4.6259 4.7338 4.7338 5.1415 5.1415 6.7968 6.7968 7.4592 7.4592 7.5541 7.5541 7.8802 7.8802 7.9446 7.9446 8.3079 8.3079 k = 0.1875 0.4425-0.2368 ( 29710 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6904 -40.6904 -40.6896 -40.6896 -40.6675 -40.6675 -40.6671 -40.6671 -40.6651 -40.6651 -40.6650 -40.6650 -7.8396 -7.8396 -7.8068 -7.8068 -6.1481 -6.1481 -5.8326 -5.8326 -4.7918 -4.7918 -4.2418 -4.2418 -1.8740 -1.8740 -1.5798 -1.5798 0.0704 0.0704 0.2024 0.2024 0.8874 0.8874 0.9356 0.9356 1.1399 1.1399 1.8551 1.8551 2.0583 2.0583 2.0714 2.0714 3.0414 3.0414 3.2155 3.2155 3.5150 3.5150 3.8992 3.8992 4.4267 4.4267 4.6116 4.6116 4.7148 4.7148 5.0958 5.0958 6.7732 6.7732 7.4279 7.4279 7.5126 7.5126 7.8252 7.8252 8.0168 8.0168 8.2954 8.2954 k = 0.1719 0.4425-0.2368 ( 29724 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6904 -40.6904 -40.6896 -40.6896 -40.6675 -40.6675 -40.6672 -40.6672 -40.6651 -40.6651 -40.6649 -40.6649 -7.8581 -7.8581 -7.8277 -7.8277 -6.0935 -6.0935 -5.7664 -5.7664 -4.8511 -4.8511 -4.3063 -4.3063 -1.8177 -1.8177 -1.4963 -1.4963 0.0305 0.0305 0.2407 0.2407 0.8112 0.8112 0.9479 0.9479 1.2048 1.2048 1.8204 1.8204 2.0112 2.0112 2.1003 2.1003 2.9713 2.9713 3.2211 3.2211 3.5314 3.5314 3.9406 3.9406 4.4131 4.4131 4.5986 4.5986 4.6963 4.6963 5.0505 5.0505 6.7477 6.7477 7.3919 7.3919 7.4789 7.4789 7.7704 7.7704 8.0887 8.0887 8.2868 8.2868 k = 0.1562 0.4425-0.2368 ( 29716 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6904 -40.6904 -40.6896 -40.6896 -40.6675 -40.6675 -40.6672 -40.6672 -40.6650 -40.6650 -40.6649 -40.6649 -7.8750 -7.8750 -7.8469 -7.8469 -6.0389 -6.0389 -5.7001 -5.7001 -4.9098 -4.9098 -4.3708 -4.3708 -1.7656 -1.7656 -1.4115 -1.4115 -0.0072 -0.0072 0.2820 0.2820 0.7307 0.7307 0.9606 0.9606 1.2740 1.2740 1.7769 1.7769 1.9580 1.9580 2.1384 2.1384 2.8991 2.8991 3.2276 3.2276 3.5492 3.5492 3.9828 3.9828 4.4006 4.4006 4.5867 4.5867 4.6790 4.6790 5.0061 5.0061 6.7200 6.7200 7.3542 7.3542 7.4513 7.4513 7.7180 7.7180 8.1583 8.1583 8.2816 8.2816 k = 0.1406 0.4425-0.2368 ( 29706 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6905 -40.6905 -40.6897 -40.6897 -40.6675 -40.6675 -40.6672 -40.6672 -40.6650 -40.6650 -40.6648 -40.6648 -7.8903 -7.8903 -7.8643 -7.8643 -5.9843 -5.9843 -5.6338 -5.6338 -4.9678 -4.9678 -4.4355 -4.4355 -1.7176 -1.7176 -1.3262 -1.3262 -0.0423 -0.0423 0.3261 0.3261 0.6482 0.6482 0.9729 0.9729 1.3455 1.3455 1.7271 1.7271 1.9085 1.9085 2.1746 2.1746 2.8262 2.8262 3.2339 3.2339 3.5680 3.5680 4.0246 4.0246 4.3894 4.3894 4.5759 4.5759 4.6633 4.6633 4.9629 4.9629 6.6901 6.6901 7.3181 7.3181 7.4278 7.4278 7.6689 7.6689 8.2248 8.2248 8.2791 8.2791 k = 0.1250 0.4425-0.2368 ( 29704 PWs) bands (ev): -40.6981 -40.6981 -40.6973 -40.6973 -40.6905 -40.6905 -40.6897 -40.6897 -40.6676 -40.6676 -40.6672 -40.6672 -40.6650 -40.6650 -40.6648 -40.6648 -7.9039 -7.9039 -7.8800 -7.8800 -5.9296 -5.9296 -5.5678 -5.5678 -5.0249 -5.0249 -4.5002 -4.5002 -1.6738 -1.6738 -1.2412 -1.2412 -0.0746 -0.0746 0.3730 0.3730 0.5652 0.5652 0.9837 0.9837 1.4186 1.4186 1.6744 1.6744 1.8619 1.8619 2.2077 2.2077 2.7536 2.7536 3.2397 3.2397 3.5873 3.5873 4.0649 4.0649 4.3799 4.3799 4.5662 4.5662 4.6498 4.6498 4.9210 4.9210 6.6583 6.6583 7.2859 7.2859 7.4071 7.4071 7.6239 7.6239 8.2775 8.2775 8.2888 8.2888 k = 0.1094 0.4425-0.2368 ( 29694 PWs) bands (ev): -40.6981 -40.6981 -40.6972 -40.6972 -40.6905 -40.6905 -40.6897 -40.6897 -40.6676 -40.6676 -40.6672 -40.6672 -40.6649 -40.6649 -40.6647 -40.6647 -7.9160 -7.9160 -7.8939 -7.8939 -5.8749 -5.8749 -5.5023 -5.5023 -5.0811 -5.0811 -4.5651 -4.5651 -1.6343 -1.6343 -1.1575 -1.1575 -0.1036 -0.1036 0.4225 0.4225 0.4824 0.4824 0.9913 0.9913 1.4930 1.4930 1.6226 1.6226 1.8172 1.8172 2.2359 2.2359 2.6826 2.6826 3.2446 3.2446 3.6065 3.6065 4.1024 4.1024 4.3725 4.3725 4.5573 4.5573 4.6390 4.6390 4.8810 4.8810 6.6255 6.6255 7.2585 7.2585 7.3886 7.3886 7.5834 7.5834 8.2793 8.2793 8.3462 8.3462 k = 0.0938 0.4425-0.2368 ( 29700 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6905 -40.6905 -40.6897 -40.6897 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6647 -40.6647 -7.9264 -7.9264 -7.9059 -7.9059 -5.8202 -5.8202 -5.4380 -5.4380 -5.1356 -5.1356 -4.6301 -4.6301 -1.5993 -1.5993 -1.0764 -1.0764 -0.1287 -0.1287 0.4011 0.4011 0.4743 0.4743 0.9937 0.9937 1.5669 1.5669 1.5772 1.5772 1.7740 1.7740 2.2565 2.2565 2.6157 2.6157 3.2486 3.2486 3.6248 3.6248 4.1359 4.1359 4.3678 4.3678 4.5492 4.5492 4.6313 4.6313 4.8430 4.8430 6.5927 6.5927 7.2363 7.2363 7.3721 7.3721 7.5477 7.5477 8.2814 8.2814 8.3989 8.3989 k = 0.0781 0.4425-0.2368 ( 29674 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6647 -40.6647 -7.9353 -7.9353 -7.9162 -7.9162 -5.7655 -5.7655 -5.3774 -5.3774 -5.1861 -5.1861 -4.6953 -4.6953 -1.5689 -1.5689 -0.9994 -0.9994 -0.1495 -0.1495 0.3226 0.3226 0.5280 0.5280 0.9884 0.9884 1.5368 1.5368 1.6449 1.6449 1.7323 1.7323 2.2650 2.2650 2.5571 2.5571 3.2517 3.2517 3.6416 3.6416 4.1639 4.1639 4.3663 4.3663 4.5419 4.5419 4.6272 4.6272 4.8073 4.8073 6.5613 6.5613 7.2189 7.2189 7.3578 7.3578 7.5170 7.5170 8.2838 8.2838 8.4455 8.4455 k = 0.0625 0.4425-0.2368 ( 29686 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9425 -7.9425 -7.9246 -7.9246 -5.7109 -5.7109 -5.3324 -5.3324 -5.2206 -5.2206 -4.7606 -4.7606 -1.5435 -1.5435 -0.9287 -0.9287 -0.1654 -0.1654 0.2489 0.2489 0.5832 0.5832 0.9732 0.9732 1.5096 1.5096 1.6914 1.6914 1.7228 1.7228 2.2546 2.2546 2.5131 2.5131 3.2538 3.2538 3.6563 3.6563 4.1856 4.1856 4.3681 4.3681 4.5355 4.5355 4.6269 4.6269 4.7742 4.7742 6.5329 6.5329 7.2060 7.2060 7.3456 7.3456 7.4917 7.4917 8.2864 8.2864 8.4853 8.4853 k = 0.0469 0.4425-0.2368 ( 29680 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9480 -7.9480 -7.9312 -7.9312 -5.6566 -5.6566 -5.3394 -5.3394 -5.2026 -5.2026 -4.8259 -4.8259 -1.5234 -1.5234 -0.8672 -0.8672 -0.1758 -0.1758 0.1827 0.1827 0.6394 0.6394 0.9472 0.9472 1.4947 1.4947 1.6551 1.6551 1.7991 1.7991 2.2211 2.2211 2.4878 2.4878 3.2552 3.2552 3.6683 3.6683 4.2008 4.2008 4.3726 4.3726 4.5299 4.5299 4.6306 4.6306 4.7441 4.7441 6.5090 6.5090 7.1969 7.1969 7.3358 7.3358 7.4719 7.4719 8.2887 8.2887 8.5174 8.5174 k = 0.0312 0.4425-0.2368 ( 29680 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9520 -7.9520 -7.9359 -7.9359 -5.6028 -5.6028 -5.3823 -5.3823 -5.1483 -5.1483 -4.8913 -4.8913 -1.5087 -1.5087 -0.8187 -0.8187 -0.1809 -0.1809 0.1282 0.1282 0.6953 0.6953 0.9114 0.9114 1.4908 1.4908 1.6231 1.6231 1.8755 1.8755 2.1683 2.1683 2.4775 2.4775 3.2559 3.2559 3.6773 3.6773 4.2102 4.2102 4.3782 4.3782 4.5255 4.5255 4.6379 4.6379 4.7176 4.7176 6.4908 6.4908 7.1909 7.1909 7.3286 7.3286 7.4577 7.4577 8.2905 8.2905 8.5411 8.5411 k = 0.0156 0.4425-0.2368 ( 29686 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9544 -7.9544 -7.9388 -7.9388 -5.5509 -5.5509 -5.4311 -5.4311 -5.0860 -5.0860 -4.9566 -4.9566 -1.4999 -1.4999 -0.7872 -0.7872 -0.1821 -0.1821 0.0912 0.0912 0.7484 0.7484 0.8695 0.8695 1.4937 1.4937 1.5993 1.5993 1.9499 1.9499 2.1051 2.1051 2.4746 2.4746 3.2563 3.2563 3.6828 3.6828 4.2152 4.2152 4.3827 4.3827 4.5226 4.5226 4.6479 4.6479 4.6961 4.6961 6.4795 6.4795 7.1875 7.1875 7.3242 7.3242 7.4491 7.4491 8.2917 8.2917 8.5557 8.5557 k = 0.0000 0.4425-0.2368 ( 29706 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9552 -7.9552 -7.9397 -7.9397 -5.5165 -5.5165 -5.4648 -5.4648 -5.0238 -5.0238 -5.0195 -5.0195 -1.4969 -1.4969 -0.7763 -0.7763 -0.1820 -0.1820 0.0779 0.0779 0.7815 0.7815 0.8400 0.8400 1.4963 1.4963 1.5899 1.5899 2.0036 2.0036 2.0547 2.0547 2.4742 2.4742 3.2564 3.2564 3.6846 3.6846 4.2167 4.2167 4.3844 4.3844 4.5216 4.5216 4.6546 4.6546 4.6855 4.6855 6.4756 6.4756 7.1864 7.1864 7.3227 7.3227 7.4462 7.4462 8.2921 8.2921 8.5607 8.5607 k = 0.0000 0.4425-0.2368 ( 29706 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9552 -7.9552 -7.9397 -7.9397 -5.5165 -5.5165 -5.4648 -5.4648 -5.0238 -5.0238 -5.0195 -5.0195 -1.4969 -1.4969 -0.7763 -0.7763 -0.1820 -0.1820 0.0779 0.0779 0.7815 0.7815 0.8400 0.8400 1.4963 1.4963 1.5899 1.5899 2.0036 2.0036 2.0547 2.0547 2.4742 2.4742 3.2564 3.2564 3.6846 3.6846 4.2167 4.2167 4.3844 4.3844 4.5216 4.5216 4.6546 4.6546 4.6855 4.6855 6.4756 6.4756 7.1864 7.1864 7.3227 7.3227 7.4462 7.4462 8.2921 8.2921 8.5607 8.5607 k = 0.0000 0.4490-0.2246 ( 29691 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9550 -7.9550 -7.9400 -7.9400 -5.5162 -5.5162 -5.4640 -5.4640 -5.0241 -5.0241 -5.0203 -5.0203 -1.4961 -1.4961 -0.7775 -0.7775 -0.1816 -0.1816 0.0773 0.0773 0.7824 0.7824 0.8400 0.8400 1.4964 1.4964 1.5908 1.5908 2.0048 2.0048 2.0549 2.0549 2.4750 2.4750 3.2533 3.2533 3.6856 3.6856 4.2155 4.2155 4.3798 4.3798 4.5211 4.5211 4.6571 4.6571 4.6838 4.6838 6.4788 6.4788 7.1866 7.1866 7.3115 7.3115 7.4589 7.4589 8.2918 8.2918 8.5592 8.5592 k = 0.0000 0.4555-0.2125 ( 29686 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9544 -7.9544 -7.9410 -7.9410 -5.5152 -5.5152 -5.4615 -5.4615 -5.0247 -5.0247 -5.0229 -5.0229 -1.4939 -1.4939 -0.7811 -0.7811 -0.1804 -0.1804 0.0758 0.0758 0.7852 0.7852 0.8399 0.8399 1.4968 1.4968 1.5932 1.5932 2.0086 2.0086 2.0556 2.0556 2.4773 2.4773 3.2439 3.2439 3.6885 3.6885 4.2119 4.2119 4.3666 4.3666 4.5197 4.5197 4.6638 4.6638 4.6789 4.6789 6.4881 6.4881 7.1872 7.1872 7.2868 7.2868 7.4880 7.4880 8.2909 8.2909 8.5545 8.5545 k = 0.0000 0.4620-0.2004 ( 29692 PWs) bands (ev): -40.6980 -40.6980 -40.6972 -40.6972 -40.6906 -40.6906 -40.6898 -40.6898 -40.6676 -40.6676 -40.6673 -40.6673 -40.6649 -40.6649 -40.6646 -40.6646 -7.9535 -7.9535 -7.9426 -7.9426 -5.5137 -5.5137 -5.4573 -5.4573 -5.0272 -5.0272 -5.0258 -5.0258 -1.4902 -1.4902 -0.7872 -0.7872 -0.1783 -0.1783 0.0732 0.0732 0.7897 0.7897 0.8397 0.8397 1.4974 1.4974 1.5973 1.5973 2.0149 2.0149 2.0566 2.0566 2.4813 2.4813 3.2287 3.2287 3.6930 3.6930 4.2060 4.2060 4.3460 4.3460 4.5173 4.5173 4.6678 4.6678 4.6770 4.6770 6.5031 6.5031 7.1883 7.1883 7.2587 7.2587 7.5232 7.5232 8.2898 8.2898 8.5462 8.5462 k = 0.5000 0.4230 0.2732 ( 29748 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6662 -40.6662 -40.6660 -40.6660 -7.1752 -7.1752 -7.1746 -7.1746 -7.0498 -7.0498 -7.0492 -7.0492 -3.4324 -3.4324 -3.4322 -3.4322 -2.9568 -2.9568 -2.9567 -2.9567 0.1197 0.1197 0.1203 0.1203 1.0690 1.0690 1.0697 1.0697 1.1810 1.1810 1.1824 1.1824 2.4228 2.4228 2.4229 2.4229 3.1568 3.1568 3.1574 3.1574 3.9629 3.9629 3.9639 3.9639 4.8003 4.8003 4.8009 4.8009 5.2870 5.2870 5.2873 5.2873 7.0828 7.0828 7.0831 7.0831 7.6614 7.6614 7.6619 7.6619 8.6067 8.6067 8.6078 8.6078 k = 0.5000 0.4073 0.2732 ( 29734 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.1754 -7.1754 -7.1748 -7.1748 -7.0506 -7.0506 -7.0500 -7.0500 -3.4298 -3.4298 -3.4297 -3.4297 -2.9551 -2.9551 -2.9550 -2.9550 0.1236 0.1236 0.1239 0.1239 1.0538 1.0538 1.0566 1.0566 1.1933 1.1933 1.1970 1.1970 2.4205 2.4205 2.4211 2.4211 3.1648 3.1648 3.1656 3.1656 3.9400 3.9400 3.9413 3.9413 4.7906 4.7906 4.7912 4.7912 5.2814 5.2814 5.2818 5.2818 7.0919 7.0919 7.0929 7.0929 7.6803 7.6803 7.6804 7.6804 8.6012 8.6012 8.6034 8.6034 k = 0.5000 0.3917 0.2732 ( 29724 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.1759 -7.1759 -7.1754 -7.1754 -7.0518 -7.0518 -7.0513 -7.0513 -3.4254 -3.4254 -3.4253 -3.4253 -2.9530 -2.9530 -2.9529 -2.9529 0.1293 0.1293 0.1294 0.1294 1.0318 1.0318 1.0355 1.0355 1.2171 1.2171 1.2219 1.2219 2.4139 2.4139 2.4150 2.4150 3.1752 3.1752 3.1763 3.1763 3.9073 3.9073 3.9090 3.9090 4.7714 4.7714 4.7720 4.7720 5.2749 5.2749 5.2755 5.2755 7.1095 7.1095 7.1112 7.1112 7.7071 7.7071 7.7075 7.7075 8.5936 8.5936 8.5968 8.5968 k = 0.5000 0.3760 0.2732 ( 29722 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.1766 -7.1766 -7.1761 -7.1761 -7.0533 -7.0533 -7.0528 -7.0528 -3.4193 -3.4193 -3.4193 -3.4193 -2.9504 -2.9504 -2.9504 -2.9504 0.1366 0.1366 0.1368 0.1368 1.0080 1.0080 1.0120 1.0120 1.2466 1.2466 1.2519 1.2519 2.4028 2.4028 2.4044 2.4044 3.1880 3.1880 3.1894 3.1894 3.8659 3.8659 3.8678 3.8678 4.7438 4.7438 4.7443 4.7443 5.2671 5.2671 5.2679 5.2679 7.1349 7.1349 7.1372 7.1372 7.7404 7.7404 7.7413 7.7413 8.5839 8.5839 8.5883 8.5883 k = 0.5000 0.3603 0.2732 ( 29706 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.1775 -7.1775 -7.1770 -7.1770 -7.0552 -7.0552 -7.0547 -7.0547 -3.4116 -3.4116 -3.4115 -3.4115 -2.9476 -2.9476 -2.9476 -2.9476 0.1457 0.1457 0.1461 0.1461 0.9845 0.9845 0.9887 0.9887 1.2791 1.2791 1.2848 1.2848 2.3874 2.3874 2.3896 2.3896 3.2031 3.2031 3.2048 3.2048 3.8169 3.8169 3.8191 3.8191 4.7089 4.7089 4.7094 4.7094 5.2573 5.2573 5.2584 5.2584 7.1674 7.1674 7.1704 7.1704 7.7781 7.7781 7.7796 7.7796 8.5724 8.5724 8.5779 8.5779 k = 0.5000 0.3447 0.2732 ( 29724 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6666 -40.6666 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.1786 -7.1786 -7.1781 -7.1781 -7.0574 -7.0574 -7.0569 -7.0569 -3.4023 -3.4023 -3.4021 -3.4021 -2.9444 -2.9444 -2.9444 -2.9444 0.1566 0.1566 0.1572 0.1572 0.9623 0.9623 0.9665 0.9665 1.3135 1.3135 1.3195 1.3195 2.3676 2.3676 2.3704 2.3704 3.2204 3.2204 3.2225 3.2225 3.7615 3.7615 3.7640 3.7640 4.6680 4.6680 4.6686 4.6686 5.2451 5.2451 5.2465 5.2465 7.2061 7.2061 7.2096 7.2096 7.8176 7.8176 7.8196 7.8196 8.5590 8.5590 8.5655 8.5655 k = 0.5000 0.3290 0.2732 ( 29718 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6899 -40.6899 -40.6891 -40.6891 -40.6665 -40.6665 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.1799 -7.1799 -7.1794 -7.1794 -7.0599 -7.0599 -7.0594 -7.0594 -3.3914 -3.3914 -3.3913 -3.3913 -2.9410 -2.9410 -2.9410 -2.9410 0.1695 0.1695 0.1703 0.1703 0.9418 0.9418 0.9460 0.9460 1.3491 1.3491 1.3553 1.3553 2.3437 2.3437 2.3470 2.3470 3.2397 3.2397 3.2422 3.2422 3.7012 3.7012 3.7041 3.7041 4.6224 4.6224 4.6231 4.6231 5.2302 5.2302 5.2318 5.2318 7.2497 7.2497 7.2538 7.2538 7.8558 7.8558 7.8584 7.8584 8.5432 8.5432 8.5504 8.5504 k = 0.5000 0.3133 0.2732 ( 29722 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6665 -40.6665 -40.6665 -40.6665 -40.6661 -40.6661 -40.6660 -40.6660 -7.1814 -7.1814 -7.1808 -7.1808 -7.0627 -7.0627 -7.0621 -7.0621 -3.3792 -3.3792 -3.3789 -3.3789 -2.9375 -2.9375 -2.9374 -2.9374 0.1842 0.1842 0.1853 0.1853 0.9233 0.9233 0.9274 0.9274 1.3854 1.3854 1.3918 1.3918 2.3158 2.3158 2.3197 2.3197 3.2605 3.2605 3.2636 3.2636 3.6374 3.6374 3.6408 3.6408 4.5733 4.5733 4.5740 4.5740 5.2122 5.2122 5.2142 5.2142 7.2973 7.2973 7.3018 7.3018 7.8896 7.8896 7.8928 7.8928 8.5239 8.5239 8.5314 8.5314 k = 0.5000 0.2977 0.2732 ( 29720 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6665 -40.6665 -40.6664 -40.6664 -40.6661 -40.6661 -40.6660 -40.6660 -7.1830 -7.1830 -7.1824 -7.1824 -7.0657 -7.0657 -7.0651 -7.0651 -3.3656 -3.3656 -3.3653 -3.3653 -2.9339 -2.9339 -2.9338 -2.9338 0.2009 0.2009 0.2022 0.2022 0.9069 0.9069 0.9110 0.9110 1.4217 1.4217 1.4284 1.4284 2.2841 2.2841 2.2886 2.2886 3.2820 3.2820 3.2859 3.2859 3.5718 3.5718 3.5760 3.5760 4.5218 4.5218 4.5226 4.5226 5.1911 5.1911 5.1934 5.1934 7.3476 7.3476 7.3525 7.3525 7.9161 7.9161 7.9197 7.9197 8.5002 8.5002 8.5074 8.5074 k = 0.5000 0.2820 0.2732 ( 29704 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6665 -40.6665 -40.6664 -40.6664 -40.6661 -40.6661 -40.6660 -40.6660 -7.1848 -7.1848 -7.1841 -7.1841 -7.0689 -7.0689 -7.0682 -7.0682 -3.3509 -3.3509 -3.3505 -3.3505 -2.9303 -2.9303 -2.9302 -2.9302 0.2195 0.2195 0.2211 0.2211 0.8928 0.8928 0.8968 0.8968 1.4577 1.4577 1.4646 1.4646 2.2490 2.2490 2.2541 2.2541 3.3024 3.3024 3.3077 3.3077 3.5070 3.5070 3.5126 3.5126 4.4689 4.4689 4.4698 4.4698 5.1669 5.1669 5.1694 5.1694 7.3994 7.3994 7.4047 7.4047 7.9333 7.9333 7.9371 7.9371 8.4719 8.4719 8.4783 8.4783 k = 0.5000 0.2663 0.2732 ( 29700 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6665 -40.6665 -40.6664 -40.6664 -40.6661 -40.6661 -40.6660 -40.6660 -7.1866 -7.1866 -7.1859 -7.1859 -7.0722 -7.0722 -7.0715 -7.0715 -3.3352 -3.3352 -3.3347 -3.3347 -2.9268 -2.9268 -2.9266 -2.9266 0.2401 0.2401 0.2419 0.2419 0.8809 0.8809 0.8849 0.8849 1.4927 1.4927 1.4999 1.4999 2.2109 2.2109 2.2166 2.2166 3.3166 3.3166 3.3243 3.3243 3.4487 3.4487 3.4567 3.4567 4.4154 4.4154 4.4165 4.4165 5.1395 5.1395 5.1423 5.1423 7.4516 7.4516 7.4573 7.4573 7.9400 7.9400 7.9438 7.9438 8.4402 8.4402 8.4456 8.4456 k = 0.5000 0.2507 0.2732 ( 29698 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6665 -40.6665 -40.6664 -40.6664 -40.6661 -40.6661 -40.6660 -40.6660 -7.1885 -7.1885 -7.1877 -7.1877 -7.0757 -7.0757 -7.0748 -7.0748 -3.3185 -3.3185 -3.3179 -3.3179 -2.9235 -2.9235 -2.9233 -2.9233 0.2627 0.2627 0.2648 0.2648 0.8714 0.8714 0.8753 0.8753 1.5260 1.5260 1.5335 1.5335 2.1700 2.1700 2.1765 2.1765 3.3087 3.3087 3.3176 3.3176 3.4156 3.4156 3.4248 3.4248 4.3623 4.3623 4.3636 4.3636 5.1091 5.1091 5.1122 5.1122 7.5031 7.5031 7.5090 7.5090 7.9366 7.9366 7.9401 7.9401 8.4071 8.4071 8.4115 8.4115 k = 0.5000 0.2350 0.2732 ( 29708 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6900 -40.6900 -40.6892 -40.6892 -40.6665 -40.6665 -40.6664 -40.6664 -40.6661 -40.6661 -40.6660 -40.6660 -7.1905 -7.1905 -7.1896 -7.1896 -7.0792 -7.0792 -7.0783 -7.0783 -3.3011 -3.3011 -3.3005 -3.3005 -2.9205 -2.9205 -2.9202 -2.9202 0.2872 0.2872 0.2895 0.2895 0.8642 0.8642 0.8680 0.8680 1.5569 1.5569 1.5648 1.5648 2.1269 2.1269 2.1341 2.1341 3.2694 3.2694 3.2751 3.2751 3.4210 3.4210 3.4271 3.4271 4.3104 4.3104 4.3120 4.3120 5.0759 5.0759 5.0792 5.0792 7.5527 7.5527 7.5589 7.5589 7.9243 7.9243 7.9273 7.9273 8.3745 8.3745 8.3781 8.3781 k = 0.5000 0.2193 0.2732 ( 29702 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6664 -40.6664 -40.6664 -40.6664 -40.6660 -40.6660 -40.6660 -40.6660 -7.1924 -7.1924 -7.1915 -7.1915 -7.0827 -7.0827 -7.0817 -7.0817 -3.2831 -3.2831 -3.2824 -3.2824 -2.9178 -2.9178 -2.9174 -2.9174 0.3135 0.3135 0.3161 0.3161 0.8593 0.8593 0.8631 0.8631 1.5845 1.5845 1.5929 1.5929 2.0821 2.0821 2.0900 2.0900 3.2179 3.2179 3.2214 3.2214 3.4410 3.4410 3.4450 3.4450 4.2607 4.2607 4.2627 4.2627 5.0399 5.0399 5.0435 5.0435 7.5993 7.5993 7.6056 7.6056 7.9050 7.9050 7.9075 7.9075 8.3442 8.3442 8.3470 8.3470 k = 0.5000 0.2037 0.2732 ( 29706 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6664 -40.6664 -40.6664 -40.6664 -40.6660 -40.6660 -40.6660 -40.6660 -7.1944 -7.1944 -7.1933 -7.1933 -7.0862 -7.0862 -7.0851 -7.0851 -3.2648 -3.2648 -3.2639 -3.2639 -2.9156 -2.9156 -2.9151 -2.9151 0.3415 0.3415 0.3445 0.3445 0.8567 0.8567 0.8606 0.8606 1.6080 1.6080 1.6169 1.6169 2.0359 2.0359 2.0447 2.0447 3.1668 3.1668 3.1691 3.1691 3.4633 3.4633 3.4662 3.4662 4.2142 4.2142 4.2166 4.2166 5.0015 5.0015 5.0054 5.0054 7.6414 7.6414 7.6477 7.6477 7.8810 7.8810 7.8829 7.8829 8.3176 8.3176 8.3196 8.3196 k = 0.5000 0.1880 0.2732 ( 29712 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6664 -40.6664 -40.6664 -40.6664 -40.6660 -40.6660 -40.6660 -40.6660 -7.1963 -7.1963 -7.1952 -7.1952 -7.0897 -7.0897 -7.0885 -7.0885 -3.2462 -3.2462 -3.2452 -3.2452 -2.9138 -2.9138 -2.9132 -2.9132 0.3711 0.3711 0.3746 0.3746 0.8564 0.8564 0.8604 0.8604 1.6265 1.6265 1.6359 1.6359 1.9889 1.9889 1.9986 1.9986 3.1207 3.1207 3.1223 3.1223 3.4839 3.4839 3.4862 3.4862 4.1723 4.1723 4.1751 4.1751 4.9609 4.9609 4.9651 4.9651 7.6771 7.6771 7.6834 7.6834 7.8550 7.8550 7.8563 7.8563 8.2958 8.2958 8.2972 8.2972 k = 0.5000 0.1723 0.2732 ( 29722 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6664 -40.6664 -40.6664 -40.6664 -40.6660 -40.6660 -40.6660 -40.6660 -7.1982 -7.1982 -7.1970 -7.1970 -7.0930 -7.0930 -7.0918 -7.0918 -3.2276 -3.2276 -3.2265 -3.2265 -2.9126 -2.9126 -2.9119 -2.9119 0.4021 0.4021 0.4060 0.4060 0.8583 0.8583 0.8624 0.8624 1.6390 1.6390 1.6491 1.6491 1.9417 1.9417 1.9524 1.9524 3.0818 3.0818 3.0829 3.0829 3.5006 3.5006 3.5025 3.5025 4.1366 4.1366 4.1398 4.1398 4.9184 4.9184 4.9229 4.9229 7.7032 7.7032 7.7092 7.7092 7.8309 7.8309 7.8318 7.8318 8.2798 8.2798 8.2805 8.2805 k = 0.5000 0.1567 0.2732 ( 29724 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6664 -40.6664 -40.6664 -40.6664 -40.6660 -40.6660 -40.6660 -40.6660 -7.2000 -7.2000 -7.1987 -7.1987 -7.0962 -7.0962 -7.0949 -7.0949 -3.2092 -3.2092 -3.2080 -3.2080 -2.9120 -2.9120 -2.9112 -2.9112 0.4342 0.4342 0.4386 0.4386 0.8622 0.8622 0.8665 0.8665 1.6452 1.6452 1.6559 1.6559 1.8949 1.8949 1.9064 1.9064 3.0516 3.0516 3.0523 3.0523 3.5110 3.5110 3.5127 3.5127 4.1087 4.1087 4.1124 4.1124 4.8744 4.8744 4.8792 4.8792 7.7140 7.7140 7.7191 7.7191 7.8150 7.8150 7.8160 7.8160 8.2703 8.2703 8.2704 8.2704 k = 0.5000 0.1410 0.2732 ( 29738 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6664 -40.6664 -40.6664 -40.6664 -40.6660 -40.6660 -40.6660 -40.6660 -7.2017 -7.2017 -7.2004 -7.2004 -7.0993 -7.0993 -7.0978 -7.0978 -3.1912 -3.1912 -3.1899 -3.1899 -2.9121 -2.9121 -2.9111 -2.9111 0.4670 0.4670 0.4720 0.4720 0.8680 0.8680 0.8726 0.8726 1.6446 1.6446 1.6560 1.6560 1.8488 1.8488 1.8614 1.8614 3.0312 3.0312 3.0316 3.0316 3.5134 3.5134 3.5149 3.5149 4.0904 4.0904 4.0945 4.0945 4.8292 4.8292 4.8344 4.8344 7.7058 7.7058 7.7093 7.7093 7.8118 7.8118 7.8135 7.8135 8.2670 8.2670 8.2675 8.2675 k = 0.5000 0.1253 0.2732 ( 29728 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6901 -40.6901 -40.6893 -40.6893 -40.6664 -40.6664 -40.6664 -40.6664 -40.6660 -40.6660 -40.6660 -40.6660 -7.2033 -7.2033 -7.2019 -7.2019 -7.1021 -7.1021 -7.1006 -7.1006 -3.1739 -3.1739 -3.1724 -3.1724 -2.9127 -2.9127 -2.9116 -2.9116 0.5000 0.5000 0.5057 0.5057 0.8755 0.8755 0.8805 0.8805 1.6378 1.6378 1.6498 1.6498 1.8043 1.8043 1.8177 1.8177 3.0208 3.0208 3.0209 3.0209 3.5064 3.5064 3.5076 3.5076 4.0826 4.0826 4.0872 4.0872 4.7831 4.7831 4.7888 4.7888 7.6852 7.6852 7.6876 7.6876 7.8158 7.8158 7.8179 7.8179 8.2700 8.2700 8.2711 8.2711 k = 0.5000 0.1097 0.2732 ( 29712 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6660 -40.6660 -7.2047 -7.2047 -7.2032 -7.2032 -7.1046 -7.1046 -7.1031 -7.1031 -3.1574 -3.1574 -3.1557 -3.1557 -2.9140 -2.9140 -2.9127 -2.9127 0.5325 0.5325 0.5391 0.5391 0.8843 0.8843 0.8898 0.8898 1.6255 1.6255 1.6381 1.6381 1.7617 1.7617 1.7760 1.7760 3.0202 3.0202 3.0204 3.0204 3.4899 3.4899 3.4907 3.4907 4.0854 4.0854 4.0903 4.0903 4.7368 4.7368 4.7429 4.7429 7.6607 7.6607 7.6624 7.6624 7.8202 7.8202 7.8222 7.8222 8.2783 8.2783 8.2799 8.2799 k = 0.5000 0.0940 0.2732 ( 29720 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2060 -7.2060 -7.2045 -7.2045 -7.1069 -7.1069 -7.1053 -7.1053 -3.1421 -3.1421 -3.1402 -3.1402 -2.9157 -2.9157 -2.9143 -2.9143 0.5639 0.5639 0.5714 0.5714 0.8941 0.8941 0.9003 0.9003 1.6090 1.6090 1.6222 1.6222 1.7218 1.7218 1.7369 1.7369 3.0290 3.0290 3.0294 3.0294 3.4647 3.4647 3.4650 3.4650 4.0974 4.0974 4.1028 4.1028 4.6906 4.6906 4.6974 4.6974 7.6364 7.6364 7.6376 7.6376 7.8226 7.8226 7.8243 7.8243 8.2904 8.2904 8.2925 8.2925 k = 0.5000 0.0783 0.2732 ( 29716 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2071 -7.2071 -7.2055 -7.2055 -7.1089 -7.1089 -7.1072 -7.1072 -3.1282 -3.1282 -3.1261 -3.1261 -2.9178 -2.9178 -2.9162 -2.9162 0.5932 0.5932 0.6018 0.6018 0.9043 0.9043 0.9115 0.9115 1.5903 1.5903 1.6040 1.6040 1.6853 1.6853 1.7010 1.7010 3.0461 3.0461 3.0469 3.0469 3.4323 3.4323 3.4326 3.4326 4.1164 4.1164 4.1224 4.1224 4.6454 4.6454 4.6529 4.6529 7.6141 7.6141 7.6150 7.6150 7.8229 7.8229 7.8245 7.8245 8.3045 8.3045 8.3070 8.3070 k = 0.5000 0.0627 0.2732 ( 29704 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2080 -7.2080 -7.2064 -7.2064 -7.1105 -7.1105 -7.1088 -7.1088 -3.1161 -3.1161 -3.1138 -3.1138 -2.9201 -2.9201 -2.9183 -2.9183 0.6194 0.6194 0.6291 0.6291 0.9143 0.9143 0.9225 0.9225 1.5710 1.5710 1.5853 1.5853 1.6530 1.6530 1.6695 1.6695 3.0705 3.0705 3.0718 3.0718 3.3944 3.3944 3.3953 3.3953 4.1401 4.1401 4.1468 4.1468 4.6022 4.6022 4.6106 4.6106 7.5950 7.5950 7.5956 7.5956 7.8220 7.8220 7.8233 7.8233 8.3189 8.3189 8.3216 8.3216 k = 0.5000 0.0470 0.2732 ( 29696 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2088 -7.2088 -7.2071 -7.2071 -7.1118 -7.1118 -7.1101 -7.1101 -3.1062 -3.1062 -3.1037 -3.1037 -2.9224 -2.9224 -2.9203 -2.9203 0.6414 0.6414 0.6522 0.6522 0.9234 0.9234 0.9327 0.9327 1.5532 1.5532 1.5681 1.5681 1.6262 1.6262 1.6434 1.6434 3.1008 3.1008 3.1027 3.1027 3.3531 3.3531 3.3548 3.3548 4.1653 4.1653 4.1731 4.1731 4.5625 4.5625 4.5721 4.5721 7.5795 7.5795 7.5801 7.5801 7.8204 7.8204 7.8216 7.8216 8.3320 8.3320 8.3348 8.3348 k = 0.5000 0.0313 0.2732 ( 29688 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2093 -7.2093 -7.2076 -7.2076 -7.1128 -7.1128 -7.1110 -7.1110 -3.0987 -3.0987 -3.0961 -3.0961 -2.9243 -2.9243 -2.9221 -2.9221 0.6581 0.6581 0.6698 0.6698 0.9308 0.9308 0.9411 0.9411 1.5386 1.5386 1.5543 1.5543 1.6060 1.6060 1.6237 1.6237 3.1353 3.1353 3.1383 3.1383 3.3098 3.3098 3.3129 3.3129 4.1887 4.1887 4.1978 4.1978 4.5288 4.5288 4.5398 4.5398 7.5682 7.5682 7.5687 7.5687 7.8189 7.8189 7.8199 7.8199 8.3423 8.3423 8.3453 8.3453 k = 0.5000 0.0157 0.2732 ( 29678 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2096 -7.2096 -7.2079 -7.2079 -7.1133 -7.1133 -7.1115 -7.1115 -3.0941 -3.0941 -3.0913 -3.0913 -2.9256 -2.9256 -2.9233 -2.9233 0.6685 0.6685 0.6809 0.6809 0.9356 0.9356 0.9466 0.9466 1.5291 1.5291 1.5452 1.5452 1.5933 1.5933 1.6116 1.6116 3.1711 3.1711 3.1773 3.1773 3.2664 3.2664 3.2726 3.2726 4.2059 4.2059 4.2162 4.2162 4.5053 4.5053 4.5176 4.5176 7.5614 7.5614 7.5618 7.5618 7.8178 7.8178 7.8187 7.8187 8.3490 8.3490 8.3520 8.3520 k = 0.5000-0.0000 0.2732 ( 29692 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2097 -7.2097 -7.2080 -7.2080 -7.1135 -7.1135 -7.1117 -7.1117 -3.0925 -3.0925 -3.0897 -3.0897 -2.9260 -2.9260 -2.9237 -2.9237 0.6720 0.6720 0.6846 0.6846 0.9373 0.9373 0.9486 0.9486 1.5258 1.5258 1.5421 1.5421 1.5891 1.5891 1.6074 1.6074 3.1940 3.1940 3.2095 3.2095 3.2327 3.2327 3.2482 3.2482 4.2124 4.2124 4.2232 4.2232 4.4966 4.4966 4.5095 4.5095 7.5591 7.5591 7.5594 7.5594 7.8174 7.8174 7.8183 7.8183 8.3513 8.3513 8.3543 8.3543 k = 0.5000-0.0000 0.2732 ( 29692 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2097 -7.2097 -7.2080 -7.2080 -7.1135 -7.1135 -7.1117 -7.1117 -3.0925 -3.0925 -3.0897 -3.0897 -2.9260 -2.9260 -2.9237 -2.9237 0.6720 0.6720 0.6846 0.6846 0.9373 0.9373 0.9486 0.9486 1.5258 1.5258 1.5421 1.5421 1.5891 1.5891 1.6074 1.6074 3.1940 3.1940 3.2095 3.2095 3.2327 3.2327 3.2482 3.2482 4.2124 4.2124 4.2232 4.2232 4.4966 4.4966 4.5095 4.5095 7.5591 7.5591 7.5594 7.5594 7.8174 7.8174 7.8183 7.8183 8.3513 8.3513 8.3543 8.3543 k = 0.5000-0.0000 0.2580 ( 29678 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2104 -7.2104 -7.2087 -7.2087 -7.1128 -7.1128 -7.1110 -7.1110 -3.0946 -3.0946 -3.0919 -3.0919 -2.9239 -2.9239 -2.9217 -2.9217 0.6722 0.6722 0.6848 0.6848 0.9387 0.9387 0.9499 0.9499 1.5203 1.5203 1.5333 1.5333 1.5982 1.5982 1.6133 1.6133 3.1545 3.1545 3.1591 3.1591 3.2821 3.2821 3.2868 3.2868 4.2036 4.2036 4.2137 4.2137 4.5066 4.5066 4.5187 4.5187 7.5420 7.5420 7.5425 7.5425 7.8363 7.8363 7.8370 7.8370 8.3449 8.3449 8.3480 8.3480 k = 0.5000-0.0000 0.2428 ( 29684 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2123 -7.2123 -7.2107 -7.2107 -7.1106 -7.1106 -7.1089 -7.1089 -3.1007 -3.1007 -3.0982 -3.0982 -2.9180 -2.9180 -2.9160 -2.9160 0.6729 0.6729 0.6852 0.6852 0.9430 0.9430 0.9539 0.9539 1.5071 1.5071 1.5159 1.5159 1.6168 1.6168 1.6277 1.6277 3.0961 3.0961 3.0984 3.0984 3.3398 3.3398 3.3422 3.3422 4.1805 4.1805 4.1889 4.1889 4.5328 4.5328 4.5432 4.5432 7.5019 7.5019 7.5026 7.5026 7.8814 7.8814 7.8817 7.8817 8.3275 8.3275 8.3307 8.3307 k = 0.5000-0.0000 0.2276 ( 29678 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2153 -7.2153 -7.2138 -7.2138 -7.1072 -7.1072 -7.1056 -7.1056 -3.1100 -3.1100 -3.1077 -3.1077 -2.9092 -2.9092 -2.9074 -2.9074 0.6740 0.6740 0.6859 0.6859 0.9499 0.9499 0.9605 0.9605 1.4905 1.4905 1.4966 1.4966 1.6379 1.6379 1.6461 1.6461 3.0360 3.0360 3.0375 3.0375 3.3953 3.3953 3.3969 3.3969 4.1494 4.1494 4.1560 4.1560 4.5683 4.5683 4.5770 4.5770 7.4536 7.4536 7.4545 7.4545 7.9349 7.9349 7.9352 7.9352 8.3037 8.3037 8.3072 8.3072 k = 0.5000-0.0000 0.2125 ( 29686 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2190 -7.2190 -7.2177 -7.2177 -7.1029 -7.1029 -7.1014 -7.1014 -3.1214 -3.1214 -3.1194 -3.1194 -2.8984 -2.8984 -2.8969 -2.8969 0.6755 0.6755 0.6869 0.6869 0.9593 0.9593 0.9694 0.9694 1.4730 1.4730 1.4774 1.4774 1.6598 1.6598 1.6662 1.6662 2.9761 2.9761 2.9771 2.9771 3.4472 3.4472 3.4484 3.4484 4.1156 4.1156 4.1208 4.1208 4.6081 4.6081 4.6154 4.6154 7.4050 7.4050 7.4061 7.4061 7.9829 7.9829 7.9838 7.9838 8.2822 8.2822 8.2859 8.2859 k = 0.5000-0.0000 0.1973 ( 29692 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2233 -7.2233 -7.2221 -7.2221 -7.0979 -7.0979 -7.0966 -7.0966 -3.1341 -3.1341 -3.1324 -3.1324 -2.8865 -2.8865 -2.8852 -2.8852 0.6775 0.6775 0.6883 0.6883 0.9709 0.9709 0.9804 0.9804 1.4555 1.4555 1.4587 1.4587 1.6817 1.6817 1.6869 1.6869 2.9171 2.9171 2.9178 2.9178 3.4939 3.4939 3.4950 3.4950 4.0832 4.0832 4.0873 4.0873 4.6490 4.6490 4.6552 4.6552 7.3596 7.3596 7.3608 7.3608 8.0112 8.0112 8.0123 8.0123 8.2763 8.2763 8.2799 8.2799 k = 0.5000-0.0000 0.1821 ( 29694 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2279 -7.2279 -7.2269 -7.2269 -7.0926 -7.0926 -7.0914 -7.0914 -3.1475 -3.1475 -3.1460 -3.1460 -2.8742 -2.8742 -2.8731 -2.8731 0.6800 0.6800 0.6900 0.6900 0.9843 0.9843 0.9932 0.9932 1.4386 1.4386 1.4409 1.4409 1.7033 1.7033 1.7076 1.7076 2.8594 2.8594 2.8599 2.8599 3.5337 3.5337 3.5347 3.5347 4.0555 4.0555 4.0587 4.0587 4.6892 4.6892 4.6944 4.6944 7.3192 7.3192 7.3204 7.3204 8.0089 8.0089 8.0097 8.0097 8.2965 8.2965 8.2994 8.2994 k = 0.5000-0.0000 0.1669 ( 29696 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2327 -7.2327 -7.2317 -7.2317 -7.0871 -7.0871 -7.0860 -7.0860 -3.1611 -3.1611 -3.1597 -3.1597 -2.8619 -2.8619 -2.8609 -2.8609 0.6829 0.6829 0.6922 0.6922 0.9992 0.9992 1.0073 1.0073 1.4227 1.4227 1.4243 1.4243 1.7244 1.7244 1.7280 1.7280 2.8036 2.8036 2.8039 2.8039 3.5646 3.5646 3.5655 3.5655 4.0352 4.0352 4.0376 4.0376 4.7274 4.7274 4.7320 4.7320 7.2847 7.2847 7.2860 7.2860 7.9810 7.9810 7.9813 7.9813 8.3368 8.3368 8.3386 8.3386 k = 0.5000-0.0000 0.1518 ( 29706 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2373 -7.2373 -7.2365 -7.2365 -7.0816 -7.0816 -7.0806 -7.0806 -3.1744 -3.1744 -3.1732 -3.1732 -2.8499 -2.8499 -2.8491 -2.8491 0.6861 0.6861 0.6946 0.6946 1.0152 1.0152 1.0225 1.0225 1.4079 1.4079 1.4090 1.4090 1.7446 1.7446 1.7476 1.7476 2.7501 2.7501 2.7502 2.7502 3.5848 3.5848 3.5857 3.5857 4.0245 4.0245 4.0263 4.0263 4.7630 4.7630 4.7670 4.7670 7.2565 7.2565 7.2579 7.2579 7.9397 7.9397 7.9398 7.9398 8.3838 8.3838 8.3847 8.3847 k = 0.5000-0.0000 0.1366 ( 29714 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2418 -7.2418 -7.2411 -7.2411 -7.0762 -7.0762 -7.0754 -7.0754 -3.1872 -3.1872 -3.1862 -3.1862 -2.8386 -2.8386 -2.8379 -2.8379 0.6897 0.6897 0.6974 0.6974 1.0316 1.0316 1.0382 1.0382 1.3946 1.3946 1.3952 1.3952 1.7637 1.7637 1.7663 1.7663 2.6992 2.6992 2.6993 2.6993 3.5938 3.5938 3.5948 3.5948 4.0241 4.0241 4.0253 4.0253 4.7955 4.7955 4.7989 4.7989 7.2349 7.2349 7.2362 7.2362 7.8928 7.8928 7.8932 7.8932 8.4283 8.4283 8.4284 8.4284 k = 0.5000-0.0000 0.1214 ( 29716 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6661 -40.6661 -40.6659 -40.6659 -7.2461 -7.2461 -7.2454 -7.2454 -7.0711 -7.0711 -7.0704 -7.0704 -3.1992 -3.1992 -3.1983 -3.1983 -2.8280 -2.8280 -2.8274 -2.8274 0.6934 0.6934 0.7003 0.7003 1.0480 1.0480 1.0538 1.0538 1.3828 1.3828 1.3831 1.3831 1.7816 1.7816 1.7837 1.7837 2.6516 2.6516 2.6517 2.6517 3.5930 3.5930 3.5939 3.5939 4.0327 4.0327 4.0336 4.0336 4.8246 4.8246 4.8275 4.8275 7.2194 7.2194 7.2207 7.2207 7.8451 7.8451 7.8455 7.8455 8.4645 8.4645 8.4651 8.4651 k = 0.5000-0.0000 0.1062 ( 29730 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6661 -40.6661 -40.6659 -40.6659 -7.2500 -7.2500 -7.2493 -7.2493 -7.0664 -7.0664 -7.0658 -7.0658 -3.2102 -3.2102 -3.2094 -3.2094 -2.8184 -2.8184 -2.8179 -2.8179 0.6973 0.6973 0.7034 0.7034 1.0639 1.0639 1.0689 1.0689 1.3728 1.3728 1.3729 1.3729 1.7979 1.7979 1.7997 1.7997 2.6077 2.6077 2.6079 2.6079 3.5850 3.5850 3.5859 3.5859 4.0477 4.0477 4.0483 4.0483 4.8501 4.8501 4.8526 4.8526 7.2096 7.2096 7.2109 7.2109 7.7990 7.7990 7.7994 7.7994 8.4905 8.4905 8.4916 8.4916 k = 0.5000-0.0000 0.0911 ( 29740 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6661 -40.6661 -40.6659 -40.6659 -7.2534 -7.2534 -7.2529 -7.2529 -7.0622 -7.0622 -7.0617 -7.0617 -3.2200 -3.2200 -3.2194 -3.2194 -2.8099 -2.8099 -2.8095 -2.8095 0.7011 0.7011 0.7063 0.7063 1.0786 1.0786 1.0828 1.0828 1.3644 1.3644 1.3647 1.3647 1.8125 1.8125 1.8139 1.8139 2.5680 2.5680 2.5683 2.5683 3.5728 3.5728 3.5736 3.5736 4.0660 4.0660 4.0664 4.0664 4.8720 4.8720 4.8741 4.8741 7.2047 7.2047 7.2058 7.2058 7.7562 7.7562 7.7565 7.7565 8.5059 8.5059 8.5072 8.5072 k = 0.5000-0.0000 0.0759 ( 29732 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6661 -40.6661 -40.6659 -40.6659 -7.2565 -7.2565 -7.2560 -7.2560 -7.0585 -7.0585 -7.0580 -7.0580 -3.2286 -3.2286 -3.2281 -3.2281 -2.8026 -2.8026 -2.8022 -2.8022 0.7047 0.7047 0.7091 0.7091 1.0918 1.0918 1.0952 1.0952 1.3580 1.3580 1.3584 1.3584 1.8251 1.8251 1.8263 1.8263 2.5332 2.5332 2.5334 2.5334 3.5592 3.5592 3.5598 3.5598 4.0850 4.0850 4.0853 4.0853 4.8903 4.8903 4.8921 4.8921 7.2036 7.2036 7.2047 7.2047 7.7178 7.7178 7.7181 7.7181 8.5119 8.5119 8.5134 8.5134 k = 0.5000-0.0000 0.0607 ( 29728 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6661 -40.6661 -40.6659 -40.6659 -7.2590 -7.2590 -7.2585 -7.2585 -7.0554 -7.0554 -7.0550 -7.0550 -3.2357 -3.2357 -3.2353 -3.2353 -2.7964 -2.7964 -2.7962 -2.7962 0.7080 0.7080 0.7115 0.7115 1.1029 1.1029 1.1056 1.1056 1.3533 1.3533 1.3538 1.3538 1.8357 1.8357 1.8366 1.8366 2.5038 2.5038 2.5040 2.5040 3.5459 3.5459 3.5464 3.5464 4.1026 4.1026 4.1028 4.1028 4.9052 4.9052 4.9066 4.9066 7.2051 7.2051 7.2061 7.2061 7.6851 7.6851 7.6853 7.6853 8.5112 8.5112 8.5125 8.5125 k = 0.5000-0.0000 0.0455 ( 29714 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6661 -40.6661 -40.6659 -40.6659 -7.2610 -7.2610 -7.2606 -7.2606 -7.0530 -7.0530 -7.0526 -7.0526 -3.2414 -3.2414 -3.2411 -3.2411 -2.7916 -2.7916 -2.7914 -2.7914 0.7108 0.7108 0.7135 0.7135 1.1117 1.1117 1.1137 1.1137 1.3503 1.3503 1.3508 1.3508 1.8441 1.8441 1.8447 1.8447 2.4802 2.4802 2.4804 2.4804 3.5344 3.5344 3.5348 3.5348 4.1176 4.1176 4.1177 4.1177 4.9166 4.9166 4.9177 4.9177 7.2081 7.2081 7.2089 7.2089 7.6586 7.6586 7.6588 7.6588 8.5067 8.5067 8.5078 8.5078 k = 0.5000-0.0000 0.0304 ( 29720 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6661 -40.6661 -40.6659 -40.6659 -7.2624 -7.2624 -7.2620 -7.2620 -7.0512 -7.0512 -7.0508 -7.0508 -3.2455 -3.2455 -3.2452 -3.2452 -2.7882 -2.7882 -2.7880 -2.7880 0.7131 0.7131 0.7148 0.7148 1.1181 1.1181 1.1194 1.1194 1.3485 1.3485 1.3489 1.3489 1.8501 1.8501 1.8506 1.8506 2.4630 2.4630 2.4632 2.4632 3.5257 3.5257 3.5260 3.5260 4.1288 4.1288 4.1289 4.1289 4.9248 4.9248 4.9255 4.9255 7.2114 7.2114 7.2119 7.2119 7.6393 7.6393 7.6394 7.6394 8.5012 8.5012 8.5020 8.5020 k = 0.5000-0.0000 0.0152 ( 29720 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6661 -40.6661 -40.6659 -40.6659 -7.2633 -7.2633 -7.2629 -7.2629 -7.0501 -7.0501 -7.0497 -7.0497 -3.2479 -3.2479 -3.2477 -3.2477 -2.7861 -2.7861 -2.7859 -2.7859 0.7146 0.7146 0.7155 0.7155 1.1221 1.1221 1.1227 1.1227 1.3477 1.3477 1.3479 1.3479 1.8538 1.8538 1.8541 1.8541 2.4525 2.4525 2.4527 2.4527 3.5202 3.5202 3.5204 3.5204 4.1358 4.1358 4.1358 4.1358 4.9298 4.9298 4.9302 4.9302 7.2138 7.2138 7.2142 7.2142 7.6274 7.6274 7.6275 7.6275 8.4970 8.4970 8.4975 8.4975 k = 0.5000-0.0000-0.0000 ( 29706 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6661 -40.6661 -40.6659 -40.6659 -7.2636 -7.2636 -7.2632 -7.2632 -7.0497 -7.0497 -7.0494 -7.0494 -3.2487 -3.2487 -3.2486 -3.2486 -2.7854 -2.7854 -2.7852 -2.7852 0.7154 0.7154 0.7155 0.7155 1.1235 1.1235 1.1237 1.1237 1.3475 1.3475 1.3476 1.3476 1.8551 1.8551 1.8552 1.8552 2.4490 2.4490 2.4491 2.4491 3.5184 3.5184 3.5185 3.5185 4.1381 4.1381 4.1381 4.1381 4.9315 4.9315 4.9316 4.9316 7.2147 7.2147 7.2149 7.2149 7.6234 7.6234 7.6235 7.6235 8.4956 8.4956 8.4957 8.4957 k = 0.0000 0.0000 0.2732 ( 29672 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -8.0361 -8.0361 -8.0360 -8.0360 -5.2544 -5.2544 -5.2543 -5.2543 -5.0414 -5.0414 -5.0413 -5.0413 -1.2363 -1.2363 -1.2363 -1.2363 0.0624 0.0624 0.0625 0.0625 0.6621 0.6621 0.6625 0.6625 1.6027 1.6027 1.6028 1.6028 2.1722 2.1722 2.1724 2.1724 2.9683 2.9683 2.9683 2.9683 3.7682 3.7682 3.7683 3.7683 4.0376 4.0376 4.0376 4.0376 4.7688 4.7688 4.7688 4.7688 6.6915 6.6915 6.6917 6.6917 7.0114 7.0114 7.0117 7.0117 7.4483 7.4483 7.4484 7.4484 k = 0.0156-0.0000 0.2732 ( 29692 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -8.0353 -8.0353 -8.0351 -8.0351 -5.2740 -5.2740 -5.2729 -5.2729 -5.0228 -5.0228 -5.0219 -5.0219 -1.2405 -1.2405 -1.2396 -1.2396 0.0646 0.0646 0.0661 0.0661 0.6608 0.6608 0.6619 0.6619 1.6045 1.6045 1.6048 1.6048 2.1713 2.1713 2.1720 2.1720 2.9668 2.9668 2.9682 2.9682 3.7604 3.7604 3.7649 3.7649 4.0383 4.0383 4.0447 4.0447 4.7685 4.7685 4.7693 4.7693 6.6909 6.6909 6.6910 6.6910 7.0136 7.0136 7.0142 7.0142 7.4528 7.4528 7.4535 7.4535 k = 0.0312-0.0000 0.2732 ( 29678 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -8.0326 -8.0326 -8.0324 -8.0324 -5.3192 -5.3192 -5.3176 -5.3176 -4.9783 -4.9783 -4.9770 -4.9770 -1.2521 -1.2521 -1.2503 -1.2503 0.0723 0.0723 0.0752 0.0752 0.6576 0.6576 0.6595 0.6595 1.6099 1.6099 1.6104 1.6104 2.1692 2.1692 2.1706 2.1706 2.9640 2.9640 2.9667 2.9667 3.7430 3.7430 3.7510 3.7510 4.0462 4.0462 4.0579 4.0579 4.7684 4.7684 4.7700 4.7700 6.6892 6.6892 6.6893 6.6893 7.0206 7.0206 7.0216 7.0216 7.4665 7.4665 7.4679 7.4679 k = 0.0469-0.0000 0.2732 ( 29688 PWs) bands (ev): -40.6991 -40.6991 -40.6983 -40.6983 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -8.0281 -8.0281 -8.0279 -8.0279 -5.3753 -5.3753 -5.3735 -5.3735 -4.9229 -4.9229 -4.9215 -4.9215 -1.2707 -1.2707 -1.2681 -1.2681 0.0853 0.0853 0.0896 0.0896 0.6527 0.6527 0.6556 0.6556 1.6184 1.6184 1.6193 1.6193 2.1659 2.1659 2.1680 2.1680 2.9600 2.9600 2.9640 2.9640 3.7188 3.7188 3.7289 3.7289 4.0588 4.0588 4.0744 4.0744 4.7686 4.7686 4.7709 4.7709 6.6868 6.6868 6.6869 6.6869 7.0326 7.0326 7.0339 7.0339 7.4887 7.4887 7.4906 7.4906 k = 0.0625-0.0000 0.2732 ( 29700 PWs) bands (ev): -40.6990 -40.6990 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6674 -40.6674 -40.6649 -40.6649 -40.6649 -40.6649 -8.0218 -8.0218 -8.0216 -8.0216 -5.4360 -5.4360 -5.4341 -5.4341 -4.8628 -4.8628 -4.8614 -4.8614 -1.2959 -1.2959 -1.2925 -1.2925 0.1031 0.1031 0.1087 0.1087 0.6466 0.6466 0.6503 0.6503 1.6295 1.6295 1.6308 1.6308 2.1616 2.1616 2.1642 2.1642 2.9551 2.9551 2.9604 2.9604 3.6904 3.6904 3.7016 3.7016 4.0732 4.0732 4.0916 4.0916 4.7692 4.7692 4.7721 4.7721 6.6845 6.6845 6.6846 6.6846 7.0495 7.0495 7.0511 7.0511 7.5184 7.5184 7.5207 7.5207 k = 0.0781-0.0000 0.2732 ( 29700 PWs) bands (ev): -40.6990 -40.6990 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6673 -40.6673 -40.6649 -40.6649 -40.6649 -40.6649 -8.0138 -8.0138 -8.0135 -8.0135 -5.4989 -5.4989 -5.4969 -5.4969 -4.8007 -4.8007 -4.7993 -4.7993 -1.3270 -1.3270 -1.3231 -1.3231 0.1251 0.1251 0.1319 0.1319 0.6398 0.6398 0.6442 0.6442 1.6423 1.6423 1.6442 1.6442 2.1562 2.1562 2.1594 2.1594 2.9496 2.9496 2.9561 2.9561 3.6599 3.6599 3.6713 3.6713 4.0870 4.0870 4.1072 4.1072 4.7704 4.7704 4.7738 4.7738 6.6831 6.6831 6.6832 6.6832 7.0714 7.0714 7.0731 7.0731 7.5543 7.5543 7.5569 7.5569 k = 0.0938-0.0000 0.2732 ( 29698 PWs) bands (ev): -40.6990 -40.6990 -40.6982 -40.6982 -40.6895 -40.6895 -40.6887 -40.6887 -40.6674 -40.6674 -40.6673 -40.6673 -40.6649 -40.6649 -40.6649 -40.6649 -8.0039 -8.0039 -8.0036 -8.0036 -5.5631 -5.5631 -5.5610 -5.5610 -4.7373 -4.7373 -4.7361 -4.7361 -1.3636 -1.3636 -1.3591 -1.3591 0.1507 0.1507 0.1585 0.1585 0.6327 0.6327 0.6379 0.6379 1.6557 1.6557 1.6585 1.6585 2.1500 2.1500 2.1536 2.1536 2.9438 2.9438 2.9515 2.9515 3.6288 3.6288 3.6399 3.6399 4.0984 4.0984 4.1199 4.1199 4.7724 4.7724 4.7760 4.7760 6.6834 6.6834 6.6836 6.6836 7.0981 7.0981 7.0997 7.0997 7.5950 7.5950 7.5978 7.5978 k = 0.1094-0.0000 0.2732 ( 29664 PWs) bands (ev): -40.6990 -40.6990 -40.6982 -40.6982 -40.6896 -40.6896 -40.6888 -40.6888 -40.6673 -40.6673 -40.6673 -40.6673 -40.6650 -40.6650 -40.6649 -40.6649 -7.9923 -7.9923 -7.9919 -7.9919 -5.6279 -5.6279 -5.6258 -5.6258 -4.6734 -4.6734 -4.6722 -4.6722 -1.4049 -1.4049 -1.4000 -1.4000 0.1791 0.1791 0.1878 0.1878 0.6260 0.6260 0.6319 0.6319 1.6686 1.6686 1.6723 1.6723 2.1433 2.1433 2.1472 2.1472 2.9383 2.9383 2.9468 2.9468 3.5984 3.5984 3.6087 3.6087 4.1062 4.1062 4.1286 4.1286 4.7752 4.7752 4.7789 4.7789 6.6863 6.6863 6.6865 6.6865 7.1291 7.1291 7.1306 7.1306 7.6394 7.6394 7.6422 7.6422 k = 0.1250-0.0000 0.2732 ( 29666 PWs) bands (ev): -40.6990 -40.6990 -40.6982 -40.6982 -40.6896 -40.6896 -40.6888 -40.6888 -40.6673 -40.6673 -40.6673 -40.6673 -40.6650 -40.6650 -40.6649 -40.6649 -7.9789 -7.9789 -7.9785 -7.9785 -5.6932 -5.6932 -5.6911 -5.6911 -4.6090 -4.6090 -4.6079 -4.6079 -1.4504 -1.4504 -1.4452 -1.4452 0.2095 0.2095 0.2191 0.2191 0.6203 0.6203 0.6268 0.6268 1.6796 1.6796 1.6845 1.6845 2.1365 2.1365 2.1405 2.1405 2.9330 2.9330 2.9425 2.9425 3.5696 3.5696 3.5790 3.5790 4.1097 4.1097 4.1325 4.1325 4.7789 4.7789 4.7824 4.7824 6.6925 6.6925 6.6927 6.6927 7.1639 7.1639 7.1652 7.1652 7.6861 7.6861 7.6889 7.6889 k = 0.1406-0.0000 0.2732 ( 29660 PWs) bands (ev): -40.6989 -40.6989 -40.6981 -40.6981 -40.6896 -40.6896 -40.6888 -40.6888 -40.6673 -40.6673 -40.6673 -40.6673 -40.6650 -40.6650 -40.6650 -40.6650 -7.9638 -7.9638 -7.9633 -7.9633 -5.7587 -5.7587 -5.7566 -5.7566 -4.5444 -4.5444 -4.5434 -4.5434 -1.4995 -1.4995 -1.4941 -1.4941 0.2411 0.2411 0.2514 0.2514 0.6163 0.6163 0.6234 0.6234 1.6873 1.6873 1.6936 1.6936 2.1300 2.1300 2.1341 2.1341 2.9283 2.9283 2.9384 2.9384 3.5436 3.5436 3.5517 3.5517 4.1085 4.1085 4.1314 4.1314 4.7833 4.7833 4.7864 4.7864 6.7024 6.7024 6.7026 6.7026 7.2019 7.2019 7.2030 7.2030 7.7343 7.7343 7.7369 7.7369 k = 0.1562-0.0000 0.2732 ( 29660 PWs) bands (ev): -40.6989 -40.6989 -40.6981 -40.6981 -40.6896 -40.6896 -40.6888 -40.6888 -40.6673 -40.6673 -40.6672 -40.6672 -40.6650 -40.6650 -40.6650 -40.6650 -7.9468 -7.9468 -7.9463 -7.9463 -5.8243 -5.8243 -5.8222 -5.8222 -4.4795 -4.4795 -4.4786 -4.4786 -1.5518 -1.5518 -1.5463 -1.5463 0.2732 0.2732 0.2840 0.2840 0.6148 0.6148 0.6225 0.6225 1.6906 1.6906 1.6983 1.6983 2.1243 2.1243 2.1285 2.1285 2.9240 2.9240 2.9346 2.9346 3.5214 3.5214 3.5279 3.5279 4.1024 4.1024 4.1251 4.1251 4.7883 4.7883 4.7908 4.7908 6.7164 6.7164 6.7166 6.7166 7.2424 7.2424 7.2433 7.2433 7.7827 7.7827 7.7852 7.7852 k = 0.1719-0.0000 0.2732 ( 29664 PWs) bands (ev): -40.6989 -40.6989 -40.6981 -40.6981 -40.6897 -40.6897 -40.6889 -40.6889 -40.6672 -40.6672 -40.6672 -40.6672 -40.6651 -40.6651 -40.6650 -40.6650 -7.9282 -7.9282 -7.9276 -7.9276 -5.8900 -5.8900 -5.8878 -5.8878 -4.4146 -4.4146 -4.4138 -4.4138 -1.6068 -1.6068 -1.6012 -1.6012 0.3047 0.3047 0.3159 0.3159 0.6167 0.6167 0.6249 0.6249 1.6884 1.6884 1.6975 1.6975 2.1199 2.1199 2.1242 2.1242 2.9200 2.9200 2.9310 2.9310 3.5037 3.5037 3.5085 3.5085 4.0916 4.0916 4.1139 4.1139 4.7934 4.7934 4.7952 4.7952 6.7348 6.7348 6.7349 6.7349 7.2846 7.2846 7.2852 7.2852 7.8307 7.8307 7.8328 7.8328 k = 0.1875-0.0000 0.2732 ( 29666 PWs) bands (ev): -40.6988 -40.6988 -40.6980 -40.6980 -40.6897 -40.6897 -40.6889 -40.6889 -40.6672 -40.6672 -40.6672 -40.6672 -40.6651 -40.6651 -40.6651 -40.6651 -7.9078 -7.9078 -7.9072 -7.9072 -5.9555 -5.9555 -5.9533 -5.9533 -4.3495 -4.3495 -4.3488 -4.3488 -1.6642 -1.6642 -1.6586 -1.6586 0.3347 0.3347 0.3462 0.3462 0.6227 0.6227 0.6315 0.6315 1.6802 1.6802 1.6905 1.6905 2.1166 2.1166 2.1212 2.1212 2.9162 2.9162 2.9274 2.9274 3.4914 3.4914 3.4943 3.4943 4.0765 4.0765 4.0983 4.0983 4.7983 4.7983 4.7991 4.7991 6.7575 6.7575 6.7576 6.7576 7.3279 7.3279 7.3282 7.3282 7.8773 7.8773 7.8791 7.8791 k = 0.2031-0.0000 0.2732 ( 29664 PWs) bands (ev): -40.6988 -40.6988 -40.6980 -40.6980 -40.6897 -40.6897 -40.6889 -40.6889 -40.6672 -40.6672 -40.6671 -40.6671 -40.6651 -40.6651 -40.6651 -40.6651 -7.8857 -7.8857 -7.8850 -7.8850 -6.0209 -6.0209 -6.0187 -6.0187 -4.2843 -4.2843 -4.2838 -4.2838 -1.7236 -1.7236 -1.7180 -1.7180 0.3623 0.3623 0.3739 0.3739 0.6338 0.6338 0.6433 0.6433 1.6657 1.6657 1.6771 1.6771 2.1142 2.1142 2.1193 2.1193 2.9123 2.9123 2.9237 2.9237 3.4850 3.4850 3.4858 3.4858 4.0578 4.0578 4.0788 4.0788 4.8023 4.8023 4.8024 4.8024 6.7844 6.7844 6.7846 6.7846 7.3713 7.3713 7.3716 7.3716 7.9220 7.9220 7.9235 7.9235 k = 0.2188-0.0000 0.2732 ( 29674 PWs) bands (ev): -40.6987 -40.6987 -40.6979 -40.6979 -40.6898 -40.6898 -40.6890 -40.6890 -40.6671 -40.6671 -40.6671 -40.6671 -40.6652 -40.6652 -40.6651 -40.6651 -7.8619 -7.8619 -7.8611 -7.8611 -6.0861 -6.0861 -6.0839 -6.0839 -4.2190 -4.2190 -4.2186 -4.2186 -1.7847 -1.7847 -1.7792 -1.7792 0.3867 0.3867 0.3984 0.3984 0.6506 0.6506 0.6608 0.6608 1.6454 1.6454 1.6577 1.6577 2.1117 2.1117 2.1178 2.1178 2.9085 2.9085 2.9200 2.9200 3.4832 3.4832 3.4847 3.4847 4.0361 4.0361 4.0562 4.0562 4.8041 4.8041 4.8052 4.8052 6.8155 6.8155 6.8156 6.8156 7.4143 7.4143 7.4148 7.4148 7.9644 7.9644 7.9655 7.9655 k = 0.2344-0.0000 0.2732 ( 29678 PWs) bands (ev): -40.6987 -40.6987 -40.6979 -40.6979 -40.6898 -40.6898 -40.6890 -40.6890 -40.6671 -40.6671 -40.6671 -40.6671 -40.6652 -40.6652 -40.6652 -40.6652 -7.8364 -7.8364 -7.8356 -7.8356 -6.1510 -6.1510 -6.1488 -6.1488 -4.1536 -4.1536 -4.1533 -4.1533 -1.8474 -1.8474 -1.8419 -1.8419 0.4079 0.4079 0.4194 0.4194 0.6732 0.6732 0.6841 0.6841 1.6201 1.6201 1.6329 1.6329 2.1084 2.1084 2.1155 2.1155 2.9050 2.9050 2.9166 2.9166 3.4864 3.4864 3.4901 3.4901 4.0123 4.0123 4.0316 4.0316 4.8043 4.8043 4.8064 4.8064 6.8503 6.8503 6.8504 6.8504 7.4564 7.4564 7.4573 7.4573 8.0041 8.0041 8.0048 8.0048 k = 0.2500-0.0000 0.2732 ( 29690 PWs) bands (ev): -40.6987 -40.6987 -40.6979 -40.6979 -40.6898 -40.6898 -40.6890 -40.6890 -40.6671 -40.6671 -40.6670 -40.6670 -40.6653 -40.6653 -40.6652 -40.6652 -7.8092 -7.8092 -7.8083 -7.8083 -6.2156 -6.2156 -6.2134 -6.2134 -4.0881 -4.0881 -4.0880 -4.0880 -1.9113 -1.9113 -1.9059 -1.9059 0.4260 0.4260 0.4375 0.4375 0.7011 0.7011 0.7127 0.7127 1.5905 1.5905 1.6037 1.6037 2.1030 2.1030 2.1114 2.1114 2.9023 2.9023 2.9140 2.9140 3.4946 3.4946 3.5004 3.5004 3.9876 3.9876 4.0059 4.0059 4.8024 4.8024 4.8055 4.8055 6.8885 6.8885 6.8886 6.8886 7.4974 7.4974 7.4987 7.4987 8.0408 8.0408 8.0411 8.0411 k = 0.2656-0.0000 0.2732 ( 29708 PWs) bands (ev): -40.6986 -40.6986 -40.6978 -40.6978 -40.6899 -40.6899 -40.6891 -40.6891 -40.6670 -40.6670 -40.6670 -40.6670 -40.6653 -40.6653 -40.6653 -40.6653 -7.7804 -7.7804 -7.7795 -7.7795 -6.2797 -6.2797 -6.2776 -6.2776 -4.0225 -4.0225 -4.0224 -4.0224 -1.9762 -1.9762 -1.9710 -1.9710 0.4420 0.4420 0.4534 0.4534 0.7334 0.7334 0.7456 0.7456 1.5577 1.5577 1.5712 1.5712 2.0946 2.0946 2.1044 2.1044 2.9009 2.9009 2.9130 2.9130 3.5063 3.5063 3.5143 3.5143 3.9634 3.9634 3.9805 3.9805 4.7981 4.7981 4.8022 4.8022 6.9297 6.9297 6.9299 6.9299 7.5374 7.5374 7.5389 7.5389 8.0742 8.0742 8.0742 8.0742 k = 0.2812-0.0000 0.2732 ( 29696 PWs) bands (ev): -40.6986 -40.6986 -40.6978 -40.6978 -40.6899 -40.6899 -40.6891 -40.6891 -40.6670 -40.6670 -40.6669 -40.6669 -40.6654 -40.6654 -40.6653 -40.6653 -7.7499 -7.7499 -7.7490 -7.7490 -6.3434 -6.3434 -6.3413 -6.3413 -3.9569 -3.9569 -3.9567 -3.9567 -2.0421 -2.0421 -2.0370 -2.0370 0.4567 0.4567 0.4680 0.4680 0.7689 0.7689 0.7816 0.7816 1.5228 1.5228 1.5364 1.5364 2.0825 2.0825 2.0937 2.0937 2.9017 2.9017 2.9142 2.9142 3.5195 3.5195 3.5296 3.5296 3.9413 3.9413 3.9572 3.9572 4.7912 4.7912 4.7963 4.7963 6.9735 6.9735 6.9737 6.9737 7.5763 7.5763 7.5782 7.5782 8.1037 8.1037 8.1040 8.1040 k = 0.2969-0.0000 0.2732 ( 29696 PWs) bands (ev): -40.6985 -40.6985 -40.6977 -40.6977 -40.6899 -40.6899 -40.6891 -40.6891 -40.6669 -40.6669 -40.6669 -40.6669 -40.6654 -40.6654 -40.6654 -40.6654 -7.7179 -7.7179 -7.7169 -7.7169 -6.4066 -6.4066 -6.4045 -6.4045 -3.8911 -3.8911 -3.8908 -3.8908 -2.1087 -2.1087 -2.1038 -2.1038 0.4709 0.4709 0.4821 0.4821 0.8065 0.8065 0.8197 0.8197 1.4867 1.4867 1.5004 1.5004 2.0661 2.0661 2.0786 2.0786 2.9052 2.9052 2.9181 2.9181 3.5318 3.5318 3.5438 3.5438 3.9237 3.9237 3.9384 3.9384 4.7815 4.7815 4.7874 4.7874 7.0195 7.0195 7.0196 7.0196 7.6146 7.6146 7.6167 7.6167 8.1292 8.1292 8.1298 8.1298 k = 0.3125-0.0000 0.2732 ( 29696 PWs) bands (ev): -40.6985 -40.6985 -40.6977 -40.6977 -40.6900 -40.6900 -40.6892 -40.6892 -40.6669 -40.6669 -40.6668 -40.6668 -40.6655 -40.6655 -40.6654 -40.6654 -7.6842 -7.6842 -7.6832 -7.6832 -6.4692 -6.4692 -6.4671 -6.4671 -3.8252 -3.8252 -3.8247 -3.8247 -2.1760 -2.1760 -2.1712 -2.1712 0.4852 0.4852 0.4964 0.4964 0.8450 0.8450 0.8586 0.8586 1.4506 1.4506 1.4644 1.4644 2.0452 2.0452 2.0590 2.0590 2.9119 2.9119 2.9252 2.9252 3.5398 3.5398 3.5537 3.5537 3.9132 3.9132 3.9266 3.9266 4.7688 4.7688 4.7756 4.7756 7.0672 7.0672 7.0673 7.0673 7.6523 7.6523 7.6546 7.6546 8.1505 8.1505 8.1513 8.1513 k = 0.3281-0.0000 0.2732 ( 29708 PWs) bands (ev): -40.6985 -40.6985 -40.6977 -40.6977 -40.6900 -40.6900 -40.6892 -40.6892 -40.6668 -40.6668 -40.6668 -40.6668 -40.6655 -40.6655 -40.6655 -40.6655 -7.6490 -7.6490 -7.6479 -7.6479 -6.5312 -6.5312 -6.5291 -6.5291 -3.7592 -3.7592 -3.7585 -3.7585 -2.2437 -2.2437 -2.2391 -2.2391 0.5000 0.5000 0.5113 0.5113 0.8832 0.8832 0.8970 0.8970 1.4158 1.4158 1.4296 1.4296 2.0199 2.0199 2.0347 2.0347 2.9220 2.9220 2.9357 2.9357 3.5407 3.5407 3.5562 3.5562 3.9123 3.9123 3.9245 3.9245 4.7531 4.7531 4.7608 4.7608 7.1161 7.1161 7.1162 7.1162 7.6895 7.6895 7.6919 7.6919 8.1675 8.1675 8.1685 8.1685 k = 0.3438-0.0000 0.2732 ( 29694 PWs) bands (ev): -40.6984 -40.6984 -40.6976 -40.6976 -40.6900 -40.6900 -40.6892 -40.6892 -40.6668 -40.6668 -40.6667 -40.6667 -40.6656 -40.6656 -40.6655 -40.6655 -7.6123 -7.6123 -7.6111 -7.6111 -6.5925 -6.5925 -6.5904 -6.5904 -3.6930 -3.6930 -3.6922 -3.6922 -2.3117 -2.3117 -2.3073 -2.3073 0.5157 0.5157 0.5271 0.5271 0.9196 0.9196 0.9335 0.9335 1.3839 1.3839 1.3978 1.3978 1.9904 1.9904 2.0060 2.0060 2.9356 2.9356 2.9495 2.9495 3.5328 3.5328 3.5494 3.5494 3.9221 3.9221 3.9335 3.9335 4.7345 4.7345 4.7429 4.7429 7.1659 7.1659 7.1660 7.1660 7.7259 7.7259 7.7284 7.7284 8.1807 8.1807 8.1818 8.1818 k = 0.3594-0.0000 0.2732 ( 29708 PWs) bands (ev): -40.6984 -40.6984 -40.6976 -40.6976 -40.6901 -40.6901 -40.6893 -40.6893 -40.6667 -40.6667 -40.6667 -40.6667 -40.6656 -40.6656 -40.6656 -40.6656 -7.5741 -7.5741 -7.5729 -7.5729 -6.6530 -6.6530 -6.6510 -6.6510 -3.6267 -3.6267 -3.6257 -3.6257 -2.3800 -2.3800 -2.3758 -2.3758 0.5324 0.5324 0.5438 0.5438 0.9521 0.9521 0.9660 0.9660 1.3570 1.3570 1.3711 1.3711 1.9570 1.9570 1.9733 1.9733 2.9524 2.9524 2.9667 2.9667 3.5163 3.5163 3.5334 3.5334 3.9421 3.9421 3.9530 3.9530 4.7131 4.7131 4.7222 4.7222 7.2162 7.2162 7.2163 7.2163 7.7607 7.7607 7.7632 7.7632 8.1913 8.1913 8.1924 8.1924 k = 0.3750-0.0000 0.2732 ( 29692 PWs) bands (ev): -40.6984 -40.6984 -40.6976 -40.6976 -40.6901 -40.6901 -40.6893 -40.6893 -40.6667 -40.6667 -40.6666 -40.6666 -40.6657 -40.6657 -40.6656 -40.6656 -7.5345 -7.5345 -7.5332 -7.5332 -6.7127 -6.7127 -6.7107 -6.7107 -3.5603 -3.5603 -3.5592 -3.5592 -2.4485 -2.4485 -2.4444 -2.4444 0.5500 0.5500 0.5616 0.5616 0.9781 0.9781 0.9918 0.9918 1.3382 1.3382 1.3526 1.3526 1.9202 1.9202 1.9370 1.9370 2.9724 2.9724 2.9868 2.9868 3.4927 3.4927 3.5100 3.5100 3.9701 3.9701 3.9809 3.9809 4.6890 4.6890 4.6987 4.6987 7.2665 7.2665 7.2666 7.2666 7.7923 7.7923 7.7947 7.7947 8.2011 8.2011 8.2021 8.2021 k = 0.3906-0.0000 0.2732 ( 29702 PWs) bands (ev): -40.6983 -40.6983 -40.6975 -40.6975 -40.6901 -40.6901 -40.6893 -40.6893 -40.6666 -40.6666 -40.6666 -40.6666 -40.6657 -40.6657 -40.6657 -40.6657 -7.4934 -7.4934 -7.4921 -7.4921 -6.7715 -6.7715 -6.7695 -6.7695 -3.4939 -3.4939 -3.4926 -3.4926 -2.5169 -2.5169 -2.5130 -2.5130 0.5686 0.5686 0.5803 0.5803 0.9945 0.9945 1.0079 1.0079 1.3307 1.3307 1.3456 1.3456 1.8805 1.8805 1.8978 1.8978 2.9953 2.9953 3.0098 3.0098 3.4639 3.4639 3.4811 3.4811 4.0038 4.0038 4.0147 4.0147 4.6626 4.6626 4.6729 4.6729 7.3164 7.3164 7.3165 7.3165 7.8187 7.8187 7.8208 7.8208 8.2125 8.2125 8.2133 8.2133 k = 0.4062-0.0000 0.2732 ( 29694 PWs) bands (ev): -40.6983 -40.6983 -40.6975 -40.6975 -40.6901 -40.6901 -40.6893 -40.6893 -40.6666 -40.6666 -40.6665 -40.6665 -40.6658 -40.6658 -40.6657 -40.6657 -7.4511 -7.4511 -7.4497 -7.4497 -6.8292 -6.8292 -6.8273 -6.8273 -3.4276 -3.4276 -3.4260 -3.4260 -2.5851 -2.5851 -2.5815 -2.5815 0.5879 0.5879 0.5997 0.5997 0.9995 0.9995 1.0125 1.0125 1.3367 1.3367 1.3521 1.3521 1.8385 1.8385 1.8560 1.8560 3.0206 3.0206 3.0353 3.0353 3.4315 3.4315 3.4485 3.4485 4.0409 4.0409 4.0519 4.0519 4.6343 4.6343 4.6451 4.6451 7.3652 7.3652 7.3653 7.3653 7.8376 7.8376 7.8393 7.8393 8.2280 8.2280 8.2284 8.2284 k = 0.4219-0.0000 0.2732 ( 29686 PWs) bands (ev): -40.6983 -40.6983 -40.6975 -40.6975 -40.6901 -40.6901 -40.6894 -40.6894 -40.6665 -40.6665 -40.6665 -40.6665 -40.6658 -40.6658 -40.6658 -40.6658 -7.4075 -7.4075 -7.4061 -7.4061 -6.8858 -6.8858 -6.8839 -6.8839 -3.3614 -3.3614 -3.3597 -3.3597 -2.6529 -2.6529 -2.6495 -2.6495 0.6073 0.6073 0.6193 0.6193 0.9941 0.9941 1.0066 1.0066 1.3558 1.3558 1.3716 1.3716 1.7946 1.7946 1.8123 1.8123 3.0482 3.0482 3.0630 3.0630 3.3970 3.3970 3.4137 3.4137 4.0795 4.0795 4.0906 4.0906 4.6047 4.6047 4.6160 4.6160 7.4122 7.4122 7.4123 7.4123 7.8474 7.8474 7.8485 7.8485 8.2488 8.2488 8.2492 8.2492 k = 0.4375-0.0000 0.2732 ( 29700 PWs) bands (ev): -40.6983 -40.6983 -40.6975 -40.6975 -40.6902 -40.6902 -40.6894 -40.6894 -40.6665 -40.6665 -40.6664 -40.6664 -40.6659 -40.6659 -40.6658 -40.6658 -7.3629 -7.3629 -7.3615 -7.3615 -6.9411 -6.9411 -6.9393 -6.9393 -3.2958 -3.2958 -3.2939 -3.2939 -2.7200 -2.7200 -2.7168 -2.7168 0.6263 0.6263 0.6384 0.6384 0.9816 0.9816 0.9937 0.9937 1.3850 1.3850 1.4013 1.4013 1.7494 1.7494 1.7671 1.7671 3.0777 3.0777 3.0927 3.0927 3.3612 3.3612 3.3776 3.3776 4.1177 4.1177 4.1288 4.1288 4.5748 4.5748 4.5865 4.5865 7.4563 7.4563 7.4565 7.4565 7.8480 7.8480 7.8486 7.8486 8.2741 8.2741 8.2752 8.2752 k = 0.4531-0.0000 0.2732 ( 29692 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6665 -40.6665 -40.6664 -40.6664 -40.6659 -40.6659 -40.6659 -40.6659 -7.3177 -7.3177 -7.3162 -7.3162 -6.9947 -6.9947 -6.9929 -6.9929 -3.2314 -3.2314 -3.2293 -3.2293 -2.7856 -2.7856 -2.7826 -2.7826 0.6439 0.6439 0.6562 0.6562 0.9661 0.9661 0.9779 0.9779 1.4212 1.4212 1.4377 1.4377 1.7034 1.7034 1.7212 1.7212 3.1088 3.1088 3.1239 3.1239 3.3248 3.3248 3.3410 3.3410 4.1533 4.1533 4.1644 4.1644 4.5461 4.5461 4.5583 4.5583 7.4960 7.4960 7.4962 7.4962 7.8415 7.8415 7.8416 7.8416 8.3015 8.3015 8.3033 8.3033 k = 0.4688-0.0000 0.2732 ( 29692 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2727 -7.2727 -7.2712 -7.2712 -7.0457 -7.0457 -7.0439 -7.0439 -3.1700 -3.1700 -3.1676 -3.1676 -2.8478 -2.8478 -2.8451 -2.8451 0.6585 0.6585 0.6710 0.6710 0.9515 0.9515 0.9630 0.9630 1.4612 1.4612 1.4779 1.4779 1.6576 1.6576 1.6755 1.6755 3.1411 3.1411 3.1562 3.1562 3.2888 3.2888 3.3047 3.3047 4.1836 4.1836 4.1946 4.1946 4.5211 4.5211 4.5336 4.5336 7.5287 7.5287 7.5290 7.5290 7.8309 7.8309 7.8314 7.8314 8.3268 8.3268 8.3291 8.3291 k = 0.4844-0.0000 0.2732 ( 29682 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2314 -7.2314 -7.2298 -7.2298 -7.0906 -7.0906 -7.0888 -7.0888 -3.1172 -3.1172 -3.1146 -3.1146 -2.9011 -2.9011 -2.8986 -2.8986 0.6685 0.6685 0.6810 0.6810 0.9411 0.9411 0.9524 0.9524 1.5014 1.5014 1.5180 1.5180 1.6144 1.6144 1.6324 1.6324 3.1731 3.1731 3.1884 3.1884 3.2544 3.2544 3.2701 3.2701 4.2047 4.2047 4.2156 4.2156 4.5032 4.5032 4.5160 4.5160 7.5510 7.5510 7.5513 7.5513 7.8213 7.8213 7.8221 7.8221 8.3447 8.3447 8.3475 8.3475 k = 0.5000-0.0000 0.2732 ( 29692 PWs) bands (ev): -40.6982 -40.6982 -40.6974 -40.6974 -40.6902 -40.6902 -40.6894 -40.6894 -40.6664 -40.6664 -40.6663 -40.6663 -40.6660 -40.6660 -40.6659 -40.6659 -7.2097 -7.2097 -7.2080 -7.2080 -7.1135 -7.1135 -7.1117 -7.1117 -3.0925 -3.0925 -3.0897 -3.0897 -2.9260 -2.9260 -2.9237 -2.9237 0.6720 0.6720 0.6846 0.6846 0.9373 0.9373 0.9486 0.9486 1.5258 1.5258 1.5421 1.5421 1.5891 1.5891 1.6074 1.6074 3.1940 3.1940 3.2095 3.2095 3.2327 3.2327 3.2482 3.2482 4.2124 4.2124 4.2232 4.2232 4.4966 4.4966 4.5095 4.5095 7.5591 7.5591 7.5594 7.5594 7.8174 7.8174 7.8183 7.8183 8.3513 8.3513 8.3543 8.3543 Writing output data file LiP.save init_run : 0.48s CPU 0.63s WALL ( 1 calls) electrons : 613.38s CPU 618.63s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.05s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 613.37s CPU 618.62s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.12s CPU 0.16s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.32s CPU 0.43s WALL ( 235 calls) cegterg : 530.74s CPU 534.31s WALL ( 300 calls) Called by sum_band: Called by *egterg: h_psi : 368.35s CPU 372.55s WALL ( 5080 calls) s_psi : 53.62s CPU 53.54s WALL ( 5080 calls) g_psi : 0.87s CPU 0.86s WALL ( 4545 calls) cdiaghg : 94.78s CPU 95.16s WALL ( 4780 calls) cegterg:over : 30.24s CPU 30.23s WALL ( 4545 calls) cegterg:upda : 25.61s CPU 25.70s WALL ( 4545 calls) cegterg:last : 15.78s CPU 15.77s WALL ( 881 calls) cdiaghg:chol : 4.18s CPU 4.27s WALL ( 4780 calls) cdiaghg:inve : 3.11s CPU 3.10s WALL ( 4780 calls) cdiaghg:para : 6.07s CPU 5.99s WALL ( 9560 calls) Called by h_psi: h_psi:vloc : 304.94s CPU 308.80s WALL ( 5080 calls) h_psi:vnl : 62.35s CPU 62.59s WALL ( 5080 calls) add_vuspsi : 31.10s CPU 31.26s WALL ( 5080 calls) General routines calbec : 31.20s CPU 31.32s WALL ( 5080 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 293.75s CPU 297.39s WALL ( 888992 calls) davcio : 0.27s CPU 0.71s WALL ( 470 calls) Parallel routines fft_scatter : 146.73s CPU 148.73s WALL ( 889007 calls) PWSCF : 11m34.14s CPU 12m 4.43s WALL This run was terminated on: 7:11:32 1Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=