Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:30:35 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./YClO.save/ file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 90 52 15 2122 929 151 Max 91 53 16 2124 953 153 Sum 3265 1895 563 76445 33791 5471 bravais-lattice index = 14 lattice parameter (alat) = 18.0815 a.u. unit-cell volume = 776.3395 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 18.081528 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.922132 celldm(5)= 0.922132 celldm(6)= 0.922132 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.922132 0.386876 0.000000 ) a(3) = ( 0.922132 0.185602 0.339449 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -2.383530 -1.413305 ) b(2) = ( 0.000000 2.584805 -1.413305 ) b(3) = ( 0.000000 0.000000 2.945954 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cl read from file: /users/gautes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Y read from file: /users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Cl 7.00 35.45300 Cl( 1.00) Y 11.00 88.90590 Y( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 308 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0102041 -0.0243217 -0.0144215), wk = 0.0032468 k( 3) = ( 0.0204082 -0.0486435 -0.0288429), wk = 0.0032468 k( 4) = ( 0.0306122 -0.0729652 -0.0432644), wk = 0.0032468 k( 5) = ( 0.0408163 -0.0972870 -0.0576859), wk = 0.0032468 k( 6) = ( 0.0510204 -0.1216087 -0.0721074), wk = 0.0032468 k( 7) = ( 0.0612245 -0.1459304 -0.0865289), wk = 0.0032468 k( 8) = ( 0.0714286 -0.1702521 -0.1009503), wk = 0.0032468 k( 9) = ( 0.0816327 -0.1945739 -0.1153718), wk = 0.0032468 k( 10) = ( 0.0918367 -0.2188956 -0.1297933), wk = 0.0032468 k( 11) = ( 0.1020408 -0.2432174 -0.1442148), wk = 0.0032468 k( 12) = ( 0.1122449 -0.2675391 -0.1586362), wk = 0.0032468 k( 13) = ( 0.1224490 -0.2918608 -0.1730577), wk = 0.0032468 k( 14) = ( 0.1326531 -0.3161826 -0.1874792), wk = 0.0032468 k( 15) = ( 0.1428571 -0.3405043 -0.2019006), wk = 0.0032468 k( 16) = ( 0.1530612 -0.3648260 -0.2163221), wk = 0.0032468 k( 17) = ( 0.1632653 -0.3891478 -0.2307436), wk = 0.0032468 k( 18) = ( 0.1734694 -0.4134695 -0.2451651), wk = 0.0032468 k( 19) = ( 0.1836735 -0.4377913 -0.2595866), wk = 0.0032468 k( 20) = ( 0.1938776 -0.4621130 -0.2740080), wk = 0.0032468 k( 21) = ( 0.2040816 -0.4864347 -0.2884295), wk = 0.0032468 k( 22) = ( 0.2142857 -0.5107564 -0.3028510), wk = 0.0032468 k( 23) = ( 0.2244898 -0.5350782 -0.3172725), wk = 0.0032468 k( 24) = ( 0.2346939 -0.5593999 -0.3316939), wk = 0.0032468 k( 25) = ( 0.2448980 -0.5837217 -0.3461154), wk = 0.0032468 k( 26) = ( 0.2551020 -0.6080434 -0.3605369), wk = 0.0032468 k( 27) = ( 0.2653061 -0.6323651 -0.3749583), wk = 0.0032468 k( 28) = ( 0.2755102 -0.6566869 -0.3893798), wk = 0.0032468 k( 29) = ( 0.2857143 -0.6810086 -0.4038013), wk = 0.0032468 k( 30) = ( 0.2959184 -0.7053304 -0.4182228), wk = 0.0032468 k( 31) = ( 0.3061224 -0.7296521 -0.4326443), wk = 0.0032468 k( 32) = ( 0.3163265 -0.7539738 -0.4470657), wk = 0.0032468 k( 33) = ( 0.3265306 -0.7782955 -0.4614872), wk = 0.0032468 k( 34) = ( 0.3367347 -0.8026173 -0.4759087), wk = 0.0032468 k( 35) = ( 0.3469388 -0.8269390 -0.4903302), wk = 0.0032468 k( 36) = ( 0.3571429 -0.8512608 -0.5047516), wk = 0.0032468 k( 37) = ( 0.3673469 -0.8755825 -0.5191731), wk = 0.0032468 k( 38) = ( 0.3775510 -0.8999042 -0.5335946), wk = 0.0032468 k( 39) = ( 0.3877551 -0.9242260 -0.5480160), wk = 0.0032468 k( 40) = ( 0.3979592 -0.9485477 -0.5624375), wk = 0.0032468 k( 41) = ( 0.4081633 -0.9728695 -0.5768590), wk = 0.0032468 k( 42) = ( 0.4183674 -0.9971912 -0.5912805), wk = 0.0032468 k( 43) = ( 0.4285714 -1.0215129 -0.6057020), wk = 0.0032468 k( 44) = ( 0.4387755 -1.0458346 -0.6201234), wk = 0.0032468 k( 45) = ( 0.4489796 -1.0701564 -0.6345449), wk = 0.0032468 k( 46) = ( 0.4591837 -1.0944781 -0.6489664), wk = 0.0032468 k( 47) = ( 0.4693878 -1.1187999 -0.6633879), wk = 0.0032468 k( 48) = ( 0.4795918 -1.1431216 -0.6778093), wk = 0.0032468 k( 49) = ( 0.4897959 -1.1674433 -0.6922308), wk = 0.0032468 k( 50) = ( 0.5000000 -1.1917651 -0.7066523), wk = 0.0032468 k( 51) = ( 0.5000000 -1.1917651 -0.7066523), wk = 0.0032468 k( 52) = ( 0.5000000 -1.1766188 -0.7321964), wk = 0.0032468 k( 53) = ( 0.5000000 -1.1614724 -0.7577406), wk = 0.0032468 k( 54) = ( 0.5000000 -1.1463261 -0.7832848), wk = 0.0032468 k( 55) = ( 0.5000000 -1.1311799 -0.8088289), wk = 0.0032468 k( 56) = ( 0.5000000 -1.1160335 -0.8343731), wk = 0.0032468 k( 57) = ( 0.5000000 -1.1008872 -0.8599172), wk = 0.0032468 k( 58) = ( 0.5000000 -1.0857409 -0.8854614), wk = 0.0032468 k( 59) = ( 0.5000000 -1.0705946 -0.9110056), wk = 0.0032468 k( 60) = ( 0.5000000 -1.0554483 -0.9365497), wk = 0.0032468 k( 61) = ( 0.5000000 -1.0403020 -0.9620939), wk = 0.0032468 k( 62) = ( 0.5000000 -1.0251557 -0.9876380), wk = 0.0032468 k( 63) = ( 0.5000000 -1.0100094 -1.0131822), wk = 0.0032468 k( 64) = ( 0.5000000 -0.9948631 -1.0387263), wk = 0.0032468 k( 65) = ( 0.5000000 -0.9797168 -1.0642705), wk = 0.0032468 k( 66) = ( 0.5000000 -0.9645705 -1.0898147), wk = 0.0032468 k( 67) = ( 0.5000000 -0.9494242 -1.1153588), wk = 0.0032468 k( 68) = ( 0.5000000 -0.9342779 -1.1409030), wk = 0.0032468 k( 69) = ( 0.5000000 -0.9191316 -1.1664471), wk = 0.0032468 k( 70) = ( 0.5000000 -0.9039853 -1.1919913), wk = 0.0032468 k( 71) = ( 0.5000000 -0.8888389 -1.2175355), wk = 0.0032468 k( 72) = ( 0.5000000 -0.8736926 -1.2430796), wk = 0.0032468 k( 73) = ( 0.5000000 -0.8585463 -1.2686238), wk = 0.0032468 k( 74) = ( 0.5000000 -0.8434000 -1.2941679), wk = 0.0032468 k( 75) = ( 0.5000000 -0.8282537 -1.3197121), wk = 0.0032468 k( 76) = ( 0.5000000 -0.8131074 -1.3452563), wk = 0.0032468 k( 77) = ( 0.5000000 -0.7979611 -1.3708004), wk = 0.0032468 k( 78) = ( 0.5000000 -0.7828148 -1.3963446), wk = 0.0032468 k( 79) = ( 0.5000000 -0.7676685 -1.4218888), wk = 0.0032468 k( 80) = ( 0.5000000 -0.7525222 -1.4474329), wk = 0.0032468 k( 81) = ( 0.5000000 -0.7373759 -1.4729770), wk = 0.0032468 k( 82) = ( 0.8242076 -0.6721211 -1.3536321), wk = 0.0032468 k( 83) = ( 0.8182037 -0.6578108 -1.3274597), wk = 0.0032468 k( 84) = ( 0.8121999 -0.6435004 -1.3012874), wk = 0.0032468 k( 85) = ( 0.8061960 -0.6291901 -1.2751152), wk = 0.0032468 k( 86) = ( 0.8001922 -0.6148797 -1.2489428), wk = 0.0032468 k( 87) = ( 0.7941883 -0.6005694 -1.2227705), wk = 0.0032468 k( 88) = ( 0.7881845 -0.5862591 -1.1965982), wk = 0.0032468 k( 89) = ( 0.7821806 -0.5719487 -1.1704259), wk = 0.0032468 k( 90) = ( 0.7761768 -0.5576384 -1.1442536), wk = 0.0032468 k( 91) = ( 0.7701729 -0.5433280 -1.1180813), wk = 0.0032468 k( 92) = ( 0.7641691 -0.5290177 -1.0919090), wk = 0.0032468 k( 93) = ( 0.7581653 -0.5147074 -1.0657367), wk = 0.0032468 k( 94) = ( 0.7521614 -0.5003970 -1.0395644), wk = 0.0032468 k( 95) = ( 0.7461576 -0.4860867 -1.0133921), wk = 0.0032468 k( 96) = ( 0.7401537 -0.4717763 -0.9872198), wk = 0.0032468 k( 97) = ( 0.7341499 -0.4574660 -0.9610474), wk = 0.0032468 k( 98) = ( 0.7281460 -0.4431556 -0.9348751), wk = 0.0032468 k( 99) = ( 0.7221422 -0.4288453 -0.9087029), wk = 0.0032468 k( 100) = ( 0.7161384 -0.4145350 -0.8825305), wk = 0.0032468 k( 101) = ( 0.7101345 -0.4002246 -0.8563582), wk = 0.0032468 k( 102) = ( 0.7041307 -0.3859143 -0.8301859), wk = 0.0032468 k( 103) = ( 0.6981268 -0.3716039 -0.8040136), wk = 0.0032468 k( 104) = ( 0.6921230 -0.3572936 -0.7778413), wk = 0.0032468 k( 105) = ( 0.6861192 -0.3429833 -0.7516690), wk = 0.0032468 k( 106) = ( 0.6801153 -0.3286729 -0.7254967), wk = 0.0032468 k( 107) = ( 0.6741115 -0.3143626 -0.6993244), wk = 0.0032468 k( 108) = ( 0.6681076 -0.3000522 -0.6731521), wk = 0.0032468 k( 109) = ( 0.6621038 -0.2857419 -0.6469798), wk = 0.0032468 k( 110) = ( 0.6560999 -0.2714315 -0.6208075), wk = 0.0032468 k( 111) = ( 0.6500961 -0.2571212 -0.5946352), wk = 0.0032468 k( 112) = ( 0.6440922 -0.2428109 -0.5684628), wk = 0.0032468 k( 113) = ( 0.6380884 -0.2285005 -0.5422906), wk = 0.0032468 k( 114) = ( 0.6320846 -0.2141902 -0.5161183), wk = 0.0032468 k( 115) = ( 0.6260807 -0.1998798 -0.4899459), wk = 0.0032468 k( 116) = ( 0.6200769 -0.1855695 -0.4637736), wk = 0.0032468 k( 117) = ( 0.6140730 -0.1712592 -0.4376013), wk = 0.0032468 k( 118) = ( 0.6080692 -0.1569488 -0.4114290), wk = 0.0032468 k( 119) = ( 0.6020653 -0.1426385 -0.3852567), wk = 0.0032468 k( 120) = ( 0.5960615 -0.1283281 -0.3590844), wk = 0.0032468 k( 121) = ( 0.5900576 -0.1140178 -0.3329121), wk = 0.0032468 k( 122) = ( 0.5840538 -0.0997075 -0.3067398), wk = 0.0032468 k( 123) = ( 0.5780500 -0.0853971 -0.2805675), wk = 0.0032468 k( 124) = ( 0.5720461 -0.0710868 -0.2543952), wk = 0.0032468 k( 125) = ( 0.5660423 -0.0567764 -0.2282229), wk = 0.0032468 k( 126) = ( 0.5600384 -0.0424661 -0.2020505), wk = 0.0032468 k( 127) = ( 0.5540346 -0.0281557 -0.1758783), wk = 0.0032468 k( 128) = ( 0.5480308 -0.0138454 -0.1497060), wk = 0.0032468 k( 129) = ( 0.5420269 0.0004650 -0.1235336), wk = 0.0032468 k( 130) = ( 0.5360231 0.0147753 -0.0973613), wk = 0.0032468 k( 131) = ( 0.5300192 0.0290856 -0.0711890), wk = 0.0032468 k( 132) = ( 0.5240154 0.0433960 -0.0450167), wk = 0.0032468 k( 133) = ( 0.5180115 0.0577063 -0.0188444), wk = 0.0032468 k( 134) = ( 0.5120077 0.0720166 0.0073279), wk = 0.0032468 k( 135) = ( 0.5060038 0.0863270 0.0335002), wk = 0.0032468 k( 136) = ( 0.5000000 0.1006373 0.0596725), wk = 0.0032468 k( 137) = ( 0.5000000 0.1006373 0.0596725), wk = 0.0032468 k( 138) = ( 0.4705882 0.0947175 0.0561624), wk = 0.0032468 k( 139) = ( 0.4411765 0.0887977 0.0526522), wk = 0.0032468 k( 140) = ( 0.4117647 0.0828778 0.0491421), wk = 0.0032468 k( 141) = ( 0.3823529 0.0769580 0.0456319), wk = 0.0032468 k( 142) = ( 0.3529412 0.0710381 0.0421218), wk = 0.0032468 k( 143) = ( 0.3235294 0.0651183 0.0386116), wk = 0.0032468 k( 144) = ( 0.2941177 0.0591984 0.0351015), wk = 0.0032468 k( 145) = ( 0.2647059 0.0532786 0.0315913), wk = 0.0032468 k( 146) = ( 0.2352941 0.0473587 0.0280812), wk = 0.0032468 k( 147) = ( 0.2058823 0.0414389 0.0245710), wk = 0.0032468 k( 148) = ( 0.1764706 0.0355191 0.0210609), wk = 0.0032468 k( 149) = ( 0.1470588 0.0295992 0.0175507), wk = 0.0032468 k( 150) = ( 0.1176471 0.0236794 0.0140406), wk = 0.0032468 k( 151) = ( 0.0882353 0.0177595 0.0105304), wk = 0.0032468 k( 152) = ( 0.0588235 0.0118397 0.0070203), wk = 0.0032468 k( 153) = ( 0.0294118 0.0059198 0.0035101), wk = 0.0032468 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 155) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 156) = ( 0.0059280 -0.0141296 -0.0258417), wk = 0.0032468 k( 157) = ( 0.0118560 -0.0282592 -0.0516834), wk = 0.0032468 k( 158) = ( 0.0177840 -0.0423887 -0.0775251), wk = 0.0032468 k( 159) = ( 0.0237120 -0.0565183 -0.1033668), wk = 0.0032468 k( 160) = ( 0.0296400 -0.0706479 -0.1292085), wk = 0.0032468 k( 161) = ( 0.0355680 -0.0847774 -0.1550502), wk = 0.0032468 k( 162) = ( 0.0414960 -0.0989070 -0.1808919), wk = 0.0032468 k( 163) = ( 0.0474240 -0.1130366 -0.2067336), wk = 0.0032468 k( 164) = ( 0.0533520 -0.1271662 -0.2325753), wk = 0.0032468 k( 165) = ( 0.0592800 -0.1412958 -0.2584170), wk = 0.0032468 k( 166) = ( 0.0652080 -0.1554253 -0.2842587), wk = 0.0032468 k( 167) = ( 0.0711361 -0.1695549 -0.3101004), wk = 0.0032468 k( 168) = ( 0.0770640 -0.1836845 -0.3359421), wk = 0.0032468 k( 169) = ( 0.0829921 -0.1978141 -0.3617839), wk = 0.0032468 k( 170) = ( 0.0889201 -0.2119436 -0.3876255), wk = 0.0032468 k( 171) = ( 0.0948481 -0.2260732 -0.4134672), wk = 0.0032468 k( 172) = ( 0.1007761 -0.2402028 -0.4393090), wk = 0.0032468 k( 173) = ( 0.1067041 -0.2543324 -0.4651506), wk = 0.0032468 k( 174) = ( 0.1126321 -0.2684620 -0.4909924), wk = 0.0032468 k( 175) = ( 0.1185601 -0.2825915 -0.5168341), wk = 0.0032468 k( 176) = ( 0.1244881 -0.2967211 -0.5426757), wk = 0.0032468 k( 177) = ( 0.1304161 -0.3108507 -0.5685175), wk = 0.0032468 k( 178) = ( 0.1363441 -0.3249802 -0.5943592), wk = 0.0032468 k( 179) = ( 0.1422721 -0.3391098 -0.6202009), wk = 0.0032468 k( 180) = ( 0.1482001 -0.3532394 -0.6460426), wk = 0.0032468 k( 181) = ( 0.1541281 -0.3673690 -0.6718843), wk = 0.0032468 k( 182) = ( 0.1600561 -0.3814986 -0.6977260), wk = 0.0032468 k( 183) = ( 0.1659841 -0.3956281 -0.7235677), wk = 0.0032468 k( 184) = ( 0.1719121 -0.4097577 -0.7494094), wk = 0.0032468 k( 185) = ( 0.1778401 -0.4238873 -0.7752511), wk = 0.0032468 k( 186) = ( 0.1837681 -0.4380169 -0.8010928), wk = 0.0032468 k( 187) = ( 0.1896961 -0.4521464 -0.8269345), wk = 0.0032468 k( 188) = ( 0.1956241 -0.4662760 -0.8527762), wk = 0.0032468 k( 189) = ( 0.2015521 -0.4804056 -0.8786179), wk = 0.0032468 k( 190) = ( 0.2074801 -0.4945352 -0.9044596), wk = 0.0032468 k( 191) = ( 0.2134081 -0.5086647 -0.9303013), wk = 0.0032468 k( 192) = ( 0.2193362 -0.5227943 -0.9561430), wk = 0.0032468 k( 193) = ( 0.2252641 -0.5369239 -0.9819847), wk = 0.0032468 k( 194) = ( 0.2311922 -0.5510535 -1.0078264), wk = 0.0032468 k( 195) = ( 0.2371202 -0.5651830 -1.0336681), wk = 0.0032468 k( 196) = ( 0.2430482 -0.5793126 -1.0595098), wk = 0.0032468 k( 197) = ( 0.2489762 -0.5934422 -1.0853515), wk = 0.0032468 k( 198) = ( 0.2549042 -0.6075718 -1.1111932), wk = 0.0032468 k( 199) = ( 0.2608322 -0.6217014 -1.1370349), wk = 0.0032468 k( 200) = ( 0.2667602 -0.6358309 -1.1628766), wk = 0.0032468 k( 201) = ( 0.2726882 -0.6499605 -1.1887183), wk = 0.0032468 k( 202) = ( 0.2786162 -0.6640901 -1.2145600), wk = 0.0032468 k( 203) = ( 0.2845442 -0.6782197 -1.2404017), wk = 0.0032468 k( 204) = ( 0.2904722 -0.6923492 -1.2662435), wk = 0.0032468 k( 205) = ( 0.2964002 -0.7064788 -1.2920851), wk = 0.0032468 k( 206) = ( 0.3023282 -0.7206084 -1.3179268), wk = 0.0032468 k( 207) = ( 0.3082562 -0.7347380 -1.3437686), wk = 0.0032468 k( 208) = ( 0.3141842 -0.7488675 -1.3696102), wk = 0.0032468 k( 209) = ( 0.3201122 -0.7629971 -1.3954520), wk = 0.0032468 k( 210) = ( 0.3260402 -0.7771267 -1.4212937), wk = 0.0032468 k( 211) = ( 0.3319682 -0.7912563 -1.4471353), wk = 0.0032468 k( 212) = ( 0.3378962 -0.8053858 -1.4729771), wk = 0.0032468 k( 213) = ( 0.6621038 -0.7047485 -1.4133046), wk = 0.0032468 k( 214) = ( 0.6560999 -0.6749194 -1.4133046), wk = 0.0032468 k( 215) = ( 0.6500961 -0.6450903 -1.4133046), wk = 0.0032468 k( 216) = ( 0.6440922 -0.6152612 -1.4133046), wk = 0.0032468 k( 217) = ( 0.6380884 -0.5854321 -1.4133046), wk = 0.0032468 k( 218) = ( 0.6320846 -0.5556030 -1.4133046), wk = 0.0032468 k( 219) = ( 0.6260807 -0.5257739 -1.4133046), wk = 0.0032468 k( 220) = ( 0.6200769 -0.4959448 -1.4133046), wk = 0.0032468 k( 221) = ( 0.6140730 -0.4661157 -1.4133046), wk = 0.0032468 k( 222) = ( 0.6080692 -0.4362865 -1.4133046), wk = 0.0032468 k( 223) = ( 0.6020653 -0.4064575 -1.4133046), wk = 0.0032468 k( 224) = ( 0.5960615 -0.3766284 -1.4133046), wk = 0.0032468 k( 225) = ( 0.5900576 -0.3467992 -1.4133046), wk = 0.0032468 k( 226) = ( 0.5840538 -0.3169701 -1.4133046), wk = 0.0032468 k( 227) = ( 0.5780500 -0.2871410 -1.4133046), wk = 0.0032468 k( 228) = ( 0.5720461 -0.2573119 -1.4133046), wk = 0.0032468 k( 229) = ( 0.5660423 -0.2274828 -1.4133046), wk = 0.0032468 k( 230) = ( 0.5600384 -0.1976537 -1.4133046), wk = 0.0032468 k( 231) = ( 0.5540346 -0.1678246 -1.4133046), wk = 0.0032468 k( 232) = ( 0.5480308 -0.1379955 -1.4133046), wk = 0.0032468 k( 233) = ( 0.5420269 -0.1081664 -1.4133046), wk = 0.0032468 k( 234) = ( 0.5360231 -0.0783373 -1.4133046), wk = 0.0032468 k( 235) = ( 0.5300192 -0.0485082 -1.4133046), wk = 0.0032468 k( 236) = ( 0.5240154 -0.0186791 -1.4133046), wk = 0.0032468 k( 237) = ( 0.5180115 0.0111500 -1.4133046), wk = 0.0032468 k( 238) = ( 0.5120077 0.0409791 -1.4133046), wk = 0.0032468 k( 239) = ( 0.5060038 0.0708082 -1.4133046), wk = 0.0032468 k( 240) = ( 0.5000000 0.1006373 -1.4133046), wk = 0.0032468 k( 241) = ( 0.5000000 0.1006373 -1.4133046), wk = 0.0032468 k( 242) = ( 0.5270173 0.1060752 -1.4033592), wk = 0.0032468 k( 243) = ( 0.5540346 0.1115131 -1.3934137), wk = 0.0032468 k( 244) = ( 0.5810519 0.1169510 -1.3834683), wk = 0.0032468 k( 245) = ( 0.6080692 0.1223889 -1.3735229), wk = 0.0032468 k( 246) = ( 0.6350865 0.1278268 -1.3635775), wk = 0.0032468 k( 247) = ( 0.6621038 0.1332647 -1.3536321), wk = 0.0032468 k( 248) = ( 0.6621038 0.1332647 -1.3536321), wk = 0.0032468 k( 249) = ( 0.6586548 0.1325705 -1.3235617), wk = 0.0032468 k( 250) = ( 0.6552057 0.1318763 -1.2934914), wk = 0.0032468 k( 251) = ( 0.6517567 0.1311821 -1.2634211), wk = 0.0032468 k( 252) = ( 0.6483077 0.1304879 -1.2333508), wk = 0.0032468 k( 253) = ( 0.6448587 0.1297937 -1.2032805), wk = 0.0032468 k( 254) = ( 0.6414097 0.1290995 -1.1732102), wk = 0.0032468 k( 255) = ( 0.6379607 0.1284053 -1.1431399), wk = 0.0032468 k( 256) = ( 0.6345116 0.1277111 -1.1130696), wk = 0.0032468 k( 257) = ( 0.6310626 0.1270169 -1.0829993), wk = 0.0032468 k( 258) = ( 0.6276136 0.1263227 -1.0529290), wk = 0.0032468 k( 259) = ( 0.6241646 0.1256285 -1.0228586), wk = 0.0032468 k( 260) = ( 0.6207156 0.1249343 -0.9927883), wk = 0.0032468 k( 261) = ( 0.6172666 0.1242401 -0.9627180), wk = 0.0032468 k( 262) = ( 0.6138175 0.1235459 -0.9326477), wk = 0.0032468 k( 263) = ( 0.6103685 0.1228517 -0.9025774), wk = 0.0032468 k( 264) = ( 0.6069195 0.1221575 -0.8725071), wk = 0.0032468 k( 265) = ( 0.6034705 0.1214633 -0.8424368), wk = 0.0032468 k( 266) = ( 0.6000215 0.1207691 -0.8123665), wk = 0.0032468 k( 267) = ( 0.5965725 0.1200749 -0.7822962), wk = 0.0032468 k( 268) = ( 0.5931234 0.1193807 -0.7522259), wk = 0.0032468 k( 269) = ( 0.5896744 0.1186865 -0.7221556), wk = 0.0032468 k( 270) = ( 0.5862254 0.1179923 -0.6920852), wk = 0.0032468 k( 271) = ( 0.5827764 0.1172981 -0.6620149), wk = 0.0032468 k( 272) = ( 0.5793274 0.1166039 -0.6319446), wk = 0.0032468 k( 273) = ( 0.5758784 0.1159097 -0.6018743), wk = 0.0032468 k( 274) = ( 0.5724293 0.1152155 -0.5718040), wk = 0.0032468 k( 275) = ( 0.5689803 0.1145213 -0.5417337), wk = 0.0032468 k( 276) = ( 0.5655313 0.1138271 -0.5116634), wk = 0.0032468 k( 277) = ( 0.5620823 0.1131329 -0.4815931), wk = 0.0032468 k( 278) = ( 0.5586333 0.1124387 -0.4515228), wk = 0.0032468 k( 279) = ( 0.5551843 0.1117445 -0.4214525), wk = 0.0032468 k( 280) = ( 0.5517353 0.1110503 -0.3913821), wk = 0.0032468 k( 281) = ( 0.5482862 0.1103561 -0.3613118), wk = 0.0032468 k( 282) = ( 0.5448372 0.1096619 -0.3312415), wk = 0.0032468 k( 283) = ( 0.5413882 0.1089677 -0.3011712), wk = 0.0032468 k( 284) = ( 0.5379392 0.1082735 -0.2711009), wk = 0.0032468 k( 285) = ( 0.5344902 0.1075793 -0.2410306), wk = 0.0032468 k( 286) = ( 0.5310411 0.1068851 -0.2109603), wk = 0.0032468 k( 287) = ( 0.5275921 0.1061909 -0.1808900), wk = 0.0032468 k( 288) = ( 0.5241431 0.1054967 -0.1508197), wk = 0.0032468 k( 289) = ( 0.5206941 0.1048025 -0.1207494), wk = 0.0032468 k( 290) = ( 0.5172451 0.1041083 -0.0906790), wk = 0.0032468 k( 291) = ( 0.5137961 0.1034141 -0.0606087), wk = 0.0032468 k( 292) = ( 0.5103471 0.1027199 -0.0305384), wk = 0.0032468 k( 293) = ( 0.5068980 0.1020257 -0.0004681), wk = 0.0032468 k( 294) = ( 0.5034490 0.1013315 0.0296022), wk = 0.0032468 k( 295) = ( 0.5000000 0.1006373 0.0596725), wk = 0.0032468 k( 296) = ( 0.5000000 -1.1917651 -0.7066523), wk = 0.0032468 k( 297) = ( 0.5270173 -1.1833786 -0.7016796), wk = 0.0032468 k( 298) = ( 0.5540346 -1.1749922 -0.6967069), wk = 0.0032468 k( 299) = ( 0.5810519 -1.1666057 -0.6917342), wk = 0.0032468 k( 300) = ( 0.6080692 -1.1582193 -0.6867614), wk = 0.0032468 k( 301) = ( 0.6350865 -1.1498329 -0.6817887), wk = 0.0032468 k( 302) = ( 0.6621038 -1.1414464 -0.6768160), wk = 0.0032468 k( 303) = ( 0.6891211 -1.1330600 -0.6718433), wk = 0.0032468 k( 304) = ( 0.7161384 -1.1246735 -0.6668706), wk = 0.0032468 k( 305) = ( 0.7431557 -1.1162871 -0.6618979), wk = 0.0032468 k( 306) = ( 0.7701729 -1.1079006 -0.6569252), wk = 0.0032468 k( 307) = ( 0.7971902 -1.0995142 -0.6519525), wk = 0.0032468 k( 308) = ( 0.8242076 -1.0911277 -0.6469798), wk = 0.0032468 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0102041 0.0000000 0.0000000), wk = 0.0032468 k( 3) = ( 0.0204082 0.0000000 0.0000000), wk = 0.0032468 k( 4) = ( 0.0306122 -0.0000000 0.0000000), wk = 0.0032468 k( 5) = ( 0.0408163 0.0000000 0.0000000), wk = 0.0032468 k( 6) = ( 0.0510204 0.0000000 0.0000000), wk = 0.0032468 k( 7) = ( 0.0612245 -0.0000000 0.0000000), wk = 0.0032468 k( 8) = ( 0.0714286 -0.0000000 0.0000000), wk = 0.0032468 k( 9) = ( 0.0816327 0.0000000 0.0000000), wk = 0.0032468 k( 10) = ( 0.0918367 0.0000000 0.0000000), wk = 0.0032468 k( 11) = ( 0.1020408 0.0000000 0.0000000), wk = 0.0032468 k( 12) = ( 0.1122449 -0.0000000 0.0000000), wk = 0.0032468 k( 13) = ( 0.1224490 -0.0000000 0.0000000), wk = 0.0032468 k( 14) = ( 0.1326531 0.0000000 0.0000000), wk = 0.0032468 k( 15) = ( 0.1428571 -0.0000000 0.0000000), wk = 0.0032468 k( 16) = ( 0.1530612 -0.0000000 0.0000000), wk = 0.0032468 k( 17) = ( 0.1632653 0.0000000 0.0000000), wk = 0.0032468 k( 18) = ( 0.1734694 0.0000000 0.0000000), wk = 0.0032468 k( 19) = ( 0.1836735 -0.0000000 0.0000000), wk = 0.0032468 k( 20) = ( 0.1938776 0.0000000 0.0000000), wk = 0.0032468 k( 21) = ( 0.2040816 0.0000000 0.0000000), wk = 0.0032468 k( 22) = ( 0.2142857 0.0000000 0.0000000), wk = 0.0032468 k( 23) = ( 0.2244898 -0.0000000 0.0000000), wk = 0.0032468 k( 24) = ( 0.2346939 -0.0000000 0.0000000), wk = 0.0032468 k( 25) = ( 0.2448980 -0.0000000 0.0000000), wk = 0.0032468 k( 26) = ( 0.2551020 -0.0000000 0.0000000), wk = 0.0032468 k( 27) = ( 0.2653061 0.0000000 0.0000000), wk = 0.0032468 k( 28) = ( 0.2755102 -0.0000000 0.0000000), wk = 0.0032468 k( 29) = ( 0.2857143 0.0000000 0.0000000), wk = 0.0032468 k( 30) = ( 0.2959184 0.0000000 0.0000000), wk = 0.0032468 k( 31) = ( 0.3061224 -0.0000000 0.0000000), wk = 0.0032468 k( 32) = ( 0.3163265 0.0000000 0.0000000), wk = 0.0032468 k( 33) = ( 0.3265306 0.0000000 0.0000000), wk = 0.0032468 k( 34) = ( 0.3367347 -0.0000000 0.0000000), wk = 0.0032468 k( 35) = ( 0.3469388 0.0000000 0.0000000), wk = 0.0032468 k( 36) = ( 0.3571429 0.0000000 0.0000000), wk = 0.0032468 k( 37) = ( 0.3673469 -0.0000000 0.0000000), wk = 0.0032468 k( 38) = ( 0.3775510 -0.0000000 0.0000000), wk = 0.0032468 k( 39) = ( 0.3877551 0.0000000 0.0000000), wk = 0.0032468 k( 40) = ( 0.3979592 0.0000000 0.0000000), wk = 0.0032468 k( 41) = ( 0.4081633 -0.0000000 0.0000000), wk = 0.0032468 k( 42) = ( 0.4183674 0.0000000 0.0000000), wk = 0.0032468 k( 43) = ( 0.4285714 0.0000000 0.0000000), wk = 0.0032468 k( 44) = ( 0.4387755 0.0000000 0.0000000), wk = 0.0032468 k( 45) = ( 0.4489796 -0.0000000 0.0000000), wk = 0.0032468 k( 46) = ( 0.4591837 0.0000000 0.0000000), wk = 0.0032468 k( 47) = ( 0.4693878 -0.0000000 0.0000000), wk = 0.0032468 k( 48) = ( 0.4795918 0.0000000 0.0000000), wk = 0.0032468 k( 49) = ( 0.4897959 -0.0000000 0.0000000), wk = 0.0032468 k( 50) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0032468 k( 51) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0032468 k( 52) = ( 0.5000000 0.0058598 -0.0058597), wk = 0.0032468 k( 53) = ( 0.5000000 0.0117195 -0.0117195), wk = 0.0032468 k( 54) = ( 0.5000000 0.0175792 -0.0175792), wk = 0.0032468 k( 55) = ( 0.5000000 0.0234390 -0.0234390), wk = 0.0032468 k( 56) = ( 0.5000000 0.0292987 -0.0292987), wk = 0.0032468 k( 57) = ( 0.5000000 0.0351585 -0.0351585), wk = 0.0032468 k( 58) = ( 0.5000000 0.0410182 -0.0410182), wk = 0.0032468 k( 59) = ( 0.5000000 0.0468780 -0.0468780), wk = 0.0032468 k( 60) = ( 0.5000000 0.0527377 -0.0527377), wk = 0.0032468 k( 61) = ( 0.5000000 0.0585975 -0.0585975), wk = 0.0032468 k( 62) = ( 0.5000000 0.0644572 -0.0644572), wk = 0.0032468 k( 63) = ( 0.5000000 0.0703170 -0.0703170), wk = 0.0032468 k( 64) = ( 0.5000000 0.0761767 -0.0761767), wk = 0.0032468 k( 65) = ( 0.5000000 0.0820365 -0.0820365), wk = 0.0032468 k( 66) = ( 0.5000000 0.0878962 -0.0878962), wk = 0.0032468 k( 67) = ( 0.5000000 0.0937560 -0.0937560), wk = 0.0032468 k( 68) = ( 0.5000000 0.0996157 -0.0996157), wk = 0.0032468 k( 69) = ( 0.5000000 0.1054755 -0.1054755), wk = 0.0032468 k( 70) = ( 0.5000000 0.1113352 -0.1113352), wk = 0.0032468 k( 71) = ( 0.5000000 0.1171950 -0.1171950), wk = 0.0032468 k( 72) = ( 0.5000000 0.1230547 -0.1230547), wk = 0.0032468 k( 73) = ( 0.5000000 0.1289145 -0.1289145), wk = 0.0032468 k( 74) = ( 0.5000000 0.1347742 -0.1347742), wk = 0.0032468 k( 75) = ( 0.5000000 0.1406340 -0.1406340), wk = 0.0032468 k( 76) = ( 0.5000000 0.1464937 -0.1464937), wk = 0.0032468 k( 77) = ( 0.5000000 0.1523535 -0.1523535), wk = 0.0032468 k( 78) = ( 0.5000000 0.1582132 -0.1582132), wk = 0.0032468 k( 79) = ( 0.5000000 0.1640730 -0.1640730), wk = 0.0032468 k( 80) = ( 0.5000000 0.1699327 -0.1699327), wk = 0.0032468 k( 81) = ( 0.5000000 0.1757924 -0.1757924), wk = 0.0032468 k( 82) = ( 0.8242076 0.5000000 0.1757925), wk = 0.0032468 k( 83) = ( 0.8182037 0.5000000 0.1817963), wk = 0.0032468 k( 84) = ( 0.8121999 0.5000000 0.1878001), wk = 0.0032468 k( 85) = ( 0.8061960 0.5000000 0.1938040), wk = 0.0032468 k( 86) = ( 0.8001922 0.5000000 0.1998078), wk = 0.0032468 k( 87) = ( 0.7941883 0.5000000 0.2058117), wk = 0.0032468 k( 88) = ( 0.7881845 0.5000000 0.2118155), wk = 0.0032468 k( 89) = ( 0.7821806 0.5000000 0.2178194), wk = 0.0032468 k( 90) = ( 0.7761768 0.5000000 0.2238232), wk = 0.0032468 k( 91) = ( 0.7701729 0.5000000 0.2298271), wk = 0.0032468 k( 92) = ( 0.7641691 0.5000000 0.2358309), wk = 0.0032468 k( 93) = ( 0.7581653 0.5000000 0.2418347), wk = 0.0032468 k( 94) = ( 0.7521614 0.5000000 0.2478386), wk = 0.0032468 k( 95) = ( 0.7461576 0.5000000 0.2538424), wk = 0.0032468 k( 96) = ( 0.7401537 0.5000000 0.2598463), wk = 0.0032468 k( 97) = ( 0.7341499 0.5000000 0.2658501), wk = 0.0032468 k( 98) = ( 0.7281460 0.5000000 0.2718540), wk = 0.0032468 k( 99) = ( 0.7221422 0.5000000 0.2778578), wk = 0.0032468 k( 100) = ( 0.7161384 0.5000000 0.2838616), wk = 0.0032468 k( 101) = ( 0.7101345 0.5000000 0.2898655), wk = 0.0032468 k( 102) = ( 0.7041307 0.5000000 0.2958693), wk = 0.0032468 k( 103) = ( 0.6981268 0.5000000 0.3018732), wk = 0.0032468 k( 104) = ( 0.6921230 0.5000000 0.3078770), wk = 0.0032468 k( 105) = ( 0.6861192 0.5000000 0.3138809), wk = 0.0032468 k( 106) = ( 0.6801153 0.5000000 0.3198847), wk = 0.0032468 k( 107) = ( 0.6741115 0.5000000 0.3258885), wk = 0.0032468 k( 108) = ( 0.6681076 0.5000000 0.3318924), wk = 0.0032468 k( 109) = ( 0.6621038 0.5000000 0.3378962), wk = 0.0032468 k( 110) = ( 0.6560999 0.5000000 0.3439001), wk = 0.0032468 k( 111) = ( 0.6500961 0.5000000 0.3499039), wk = 0.0032468 k( 112) = ( 0.6440922 0.5000000 0.3559078), wk = 0.0032468 k( 113) = ( 0.6380884 0.5000000 0.3619116), wk = 0.0032468 k( 114) = ( 0.6320846 0.5000000 0.3679154), wk = 0.0032468 k( 115) = ( 0.6260807 0.5000000 0.3739193), wk = 0.0032468 k( 116) = ( 0.6200769 0.5000000 0.3799231), wk = 0.0032468 k( 117) = ( 0.6140730 0.5000000 0.3859270), wk = 0.0032468 k( 118) = ( 0.6080692 0.5000000 0.3919308), wk = 0.0032468 k( 119) = ( 0.6020653 0.5000000 0.3979347), wk = 0.0032468 k( 120) = ( 0.5960615 0.5000000 0.4039385), wk = 0.0032468 k( 121) = ( 0.5900576 0.5000000 0.4099423), wk = 0.0032468 k( 122) = ( 0.5840538 0.5000000 0.4159462), wk = 0.0032468 k( 123) = ( 0.5780500 0.5000000 0.4219500), wk = 0.0032468 k( 124) = ( 0.5720461 0.5000000 0.4279539), wk = 0.0032468 k( 125) = ( 0.5660423 0.5000000 0.4339577), wk = 0.0032468 k( 126) = ( 0.5600384 0.5000000 0.4399616), wk = 0.0032468 k( 127) = ( 0.5540346 0.5000000 0.4459654), wk = 0.0032468 k( 128) = ( 0.5480308 0.5000000 0.4519693), wk = 0.0032468 k( 129) = ( 0.5420269 0.5000000 0.4579731), wk = 0.0032468 k( 130) = ( 0.5360231 0.5000000 0.4639769), wk = 0.0032468 k( 131) = ( 0.5300192 0.5000000 0.4699808), wk = 0.0032468 k( 132) = ( 0.5240154 0.5000000 0.4759846), wk = 0.0032468 k( 133) = ( 0.5180115 0.5000000 0.4819885), wk = 0.0032468 k( 134) = ( 0.5120077 0.5000000 0.4879923), wk = 0.0032468 k( 135) = ( 0.5060038 0.5000000 0.4939962), wk = 0.0032468 k( 136) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 137) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 138) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0032468 k( 139) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0032468 k( 140) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0032468 k( 141) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0032468 k( 142) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0032468 k( 143) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0032468 k( 144) = ( 0.2941177 0.2941177 0.2941177), wk = 0.0032468 k( 145) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0032468 k( 146) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0032468 k( 147) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0032468 k( 148) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0032468 k( 149) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0032468 k( 150) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0032468 k( 151) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0032468 k( 152) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0032468 k( 153) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0032468 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 155) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 156) = ( 0.0059280 0.0000000 -0.0059280), wk = 0.0032468 k( 157) = ( 0.0118560 0.0000000 -0.0118560), wk = 0.0032468 k( 158) = ( 0.0177840 0.0000000 -0.0177840), wk = 0.0032468 k( 159) = ( 0.0237120 0.0000000 -0.0237120), wk = 0.0032468 k( 160) = ( 0.0296400 0.0000000 -0.0296400), wk = 0.0032468 k( 161) = ( 0.0355680 0.0000000 -0.0355680), wk = 0.0032468 k( 162) = ( 0.0414960 -0.0000000 -0.0414960), wk = 0.0032468 k( 163) = ( 0.0474240 0.0000000 -0.0474240), wk = 0.0032468 k( 164) = ( 0.0533520 0.0000000 -0.0533520), wk = 0.0032468 k( 165) = ( 0.0592800 0.0000000 -0.0592800), wk = 0.0032468 k( 166) = ( 0.0652080 0.0000000 -0.0652080), wk = 0.0032468 k( 167) = ( 0.0711361 -0.0000000 -0.0711360), wk = 0.0032468 k( 168) = ( 0.0770640 -0.0000000 -0.0770640), wk = 0.0032468 k( 169) = ( 0.0829921 -0.0000000 -0.0829921), wk = 0.0032468 k( 170) = ( 0.0889201 0.0000000 -0.0889201), wk = 0.0032468 k( 171) = ( 0.0948481 0.0000000 -0.0948481), wk = 0.0032468 k( 172) = ( 0.1007761 0.0000000 -0.1007761), wk = 0.0032468 k( 173) = ( 0.1067041 0.0000000 -0.1067041), wk = 0.0032468 k( 174) = ( 0.1126321 -0.0000000 -0.1126321), wk = 0.0032468 k( 175) = ( 0.1185601 0.0000000 -0.1185601), wk = 0.0032468 k( 176) = ( 0.1244881 0.0000000 -0.1244881), wk = 0.0032468 k( 177) = ( 0.1304161 -0.0000000 -0.1304161), wk = 0.0032468 k( 178) = ( 0.1363441 0.0000000 -0.1363441), wk = 0.0032468 k( 179) = ( 0.1422721 -0.0000000 -0.1422721), wk = 0.0032468 k( 180) = ( 0.1482001 0.0000000 -0.1482001), wk = 0.0032468 k( 181) = ( 0.1541281 -0.0000000 -0.1541281), wk = 0.0032468 k( 182) = ( 0.1600561 -0.0000000 -0.1600561), wk = 0.0032468 k( 183) = ( 0.1659841 0.0000000 -0.1659841), wk = 0.0032468 k( 184) = ( 0.1719121 0.0000000 -0.1719121), wk = 0.0032468 k( 185) = ( 0.1778401 0.0000000 -0.1778401), wk = 0.0032468 k( 186) = ( 0.1837681 -0.0000000 -0.1837681), wk = 0.0032468 k( 187) = ( 0.1896961 0.0000000 -0.1896961), wk = 0.0032468 k( 188) = ( 0.1956241 0.0000000 -0.1956241), wk = 0.0032468 k( 189) = ( 0.2015521 0.0000000 -0.2015521), wk = 0.0032468 k( 190) = ( 0.2074801 0.0000000 -0.2074801), wk = 0.0032468 k( 191) = ( 0.2134081 0.0000000 -0.2134081), wk = 0.0032468 k( 192) = ( 0.2193362 0.0000000 -0.2193361), wk = 0.0032468 k( 193) = ( 0.2252641 -0.0000000 -0.2252641), wk = 0.0032468 k( 194) = ( 0.2311922 0.0000000 -0.2311922), wk = 0.0032468 k( 195) = ( 0.2371202 0.0000000 -0.2371202), wk = 0.0032468 k( 196) = ( 0.2430482 0.0000000 -0.2430482), wk = 0.0032468 k( 197) = ( 0.2489762 0.0000000 -0.2489762), wk = 0.0032468 k( 198) = ( 0.2549042 -0.0000000 -0.2549042), wk = 0.0032468 k( 199) = ( 0.2608322 -0.0000000 -0.2608322), wk = 0.0032468 k( 200) = ( 0.2667602 0.0000000 -0.2667602), wk = 0.0032468 k( 201) = ( 0.2726882 0.0000000 -0.2726882), wk = 0.0032468 k( 202) = ( 0.2786162 -0.0000000 -0.2786162), wk = 0.0032468 k( 203) = ( 0.2845442 -0.0000000 -0.2845442), wk = 0.0032468 k( 204) = ( 0.2904722 0.0000000 -0.2904722), wk = 0.0032468 k( 205) = ( 0.2964002 0.0000000 -0.2964002), wk = 0.0032468 k( 206) = ( 0.3023282 0.0000000 -0.3023282), wk = 0.0032468 k( 207) = ( 0.3082562 0.0000000 -0.3082562), wk = 0.0032468 k( 208) = ( 0.3141842 -0.0000000 -0.3141842), wk = 0.0032468 k( 209) = ( 0.3201122 -0.0000000 -0.3201122), wk = 0.0032468 k( 210) = ( 0.3260402 0.0000000 -0.3260402), wk = 0.0032468 k( 211) = ( 0.3319682 0.0000000 -0.3319682), wk = 0.0032468 k( 212) = ( 0.3378962 0.0000000 -0.3378962), wk = 0.0032468 k( 213) = ( 0.6621038 0.3378962 0.0000000), wk = 0.0032468 k( 214) = ( 0.6560999 0.3439001 0.0000000), wk = 0.0032468 k( 215) = ( 0.6500961 0.3499039 0.0000000), wk = 0.0032468 k( 216) = ( 0.6440922 0.3559078 0.0000000), wk = 0.0032468 k( 217) = ( 0.6380884 0.3619116 0.0000000), wk = 0.0032468 k( 218) = ( 0.6320846 0.3679154 0.0000000), wk = 0.0032468 k( 219) = ( 0.6260807 0.3739193 0.0000000), wk = 0.0032468 k( 220) = ( 0.6200769 0.3799231 0.0000000), wk = 0.0032468 k( 221) = ( 0.6140730 0.3859270 0.0000000), wk = 0.0032468 k( 222) = ( 0.6080692 0.3919308 -0.0000000), wk = 0.0032468 k( 223) = ( 0.6020653 0.3979347 -0.0000000), wk = 0.0032468 k( 224) = ( 0.5960615 0.4039385 0.0000000), wk = 0.0032468 k( 225) = ( 0.5900576 0.4099424 0.0000000), wk = 0.0032468 k( 226) = ( 0.5840538 0.4159462 0.0000000), wk = 0.0032468 k( 227) = ( 0.5780500 0.4219500 0.0000000), wk = 0.0032468 k( 228) = ( 0.5720461 0.4279539 0.0000000), wk = 0.0032468 k( 229) = ( 0.5660423 0.4339577 0.0000000), wk = 0.0032468 k( 230) = ( 0.5600384 0.4399616 0.0000000), wk = 0.0032468 k( 231) = ( 0.5540346 0.4459654 0.0000000), wk = 0.0032468 k( 232) = ( 0.5480308 0.4519692 0.0000000), wk = 0.0032468 k( 233) = ( 0.5420269 0.4579731 0.0000000), wk = 0.0032468 k( 234) = ( 0.5360231 0.4639769 0.0000000), wk = 0.0032468 k( 235) = ( 0.5300192 0.4699808 0.0000000), wk = 0.0032468 k( 236) = ( 0.5240154 0.4759846 0.0000000), wk = 0.0032468 k( 237) = ( 0.5180115 0.4819885 0.0000000), wk = 0.0032468 k( 238) = ( 0.5120077 0.4879923 0.0000000), wk = 0.0032468 k( 239) = ( 0.5060038 0.4939962 0.0000000), wk = 0.0032468 k( 240) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032468 k( 241) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032468 k( 242) = ( 0.5270173 0.5270173 0.0292987), wk = 0.0032468 k( 243) = ( 0.5540346 0.5540346 0.0585975), wk = 0.0032468 k( 244) = ( 0.5810519 0.5810519 0.0878962), wk = 0.0032468 k( 245) = ( 0.6080692 0.6080692 0.1171950), wk = 0.0032468 k( 246) = ( 0.6350865 0.6350865 0.1464937), wk = 0.0032468 k( 247) = ( 0.6621038 0.6621038 0.1757924), wk = 0.0032468 k( 248) = ( 0.6621038 0.6621038 0.1757924), wk = 0.0032468 k( 249) = ( 0.6586548 0.6586548 0.1826905), wk = 0.0032468 k( 250) = ( 0.6552057 0.6552057 0.1895885), wk = 0.0032468 k( 251) = ( 0.6517567 0.6517567 0.1964866), wk = 0.0032468 k( 252) = ( 0.6483077 0.6483077 0.2033846), wk = 0.0032468 k( 253) = ( 0.6448587 0.6448587 0.2102826), wk = 0.0032468 k( 254) = ( 0.6414097 0.6414097 0.2171807), wk = 0.0032468 k( 255) = ( 0.6379607 0.6379607 0.2240787), wk = 0.0032468 k( 256) = ( 0.6345116 0.6345116 0.2309767), wk = 0.0032468 k( 257) = ( 0.6310626 0.6310626 0.2378748), wk = 0.0032468 k( 258) = ( 0.6276136 0.6276136 0.2447728), wk = 0.0032468 k( 259) = ( 0.6241646 0.6241646 0.2516708), wk = 0.0032468 k( 260) = ( 0.6207156 0.6207156 0.2585689), wk = 0.0032468 k( 261) = ( 0.6172666 0.6172666 0.2654669), wk = 0.0032468 k( 262) = ( 0.6138175 0.6138175 0.2723649), wk = 0.0032468 k( 263) = ( 0.6103685 0.6103685 0.2792630), wk = 0.0032468 k( 264) = ( 0.6069195 0.6069195 0.2861610), wk = 0.0032468 k( 265) = ( 0.6034705 0.6034705 0.2930590), wk = 0.0032468 k( 266) = ( 0.6000215 0.6000215 0.2999570), wk = 0.0032468 k( 267) = ( 0.5965725 0.5965725 0.3068551), wk = 0.0032468 k( 268) = ( 0.5931234 0.5931234 0.3137531), wk = 0.0032468 k( 269) = ( 0.5896744 0.5896744 0.3206511), wk = 0.0032468 k( 270) = ( 0.5862254 0.5862254 0.3275492), wk = 0.0032468 k( 271) = ( 0.5827764 0.5827764 0.3344472), wk = 0.0032468 k( 272) = ( 0.5793274 0.5793274 0.3413452), wk = 0.0032468 k( 273) = ( 0.5758784 0.5758784 0.3482433), wk = 0.0032468 k( 274) = ( 0.5724293 0.5724293 0.3551413), wk = 0.0032468 k( 275) = ( 0.5689803 0.5689803 0.3620393), wk = 0.0032468 k( 276) = ( 0.5655313 0.5655313 0.3689374), wk = 0.0032468 k( 277) = ( 0.5620823 0.5620823 0.3758354), wk = 0.0032468 k( 278) = ( 0.5586333 0.5586333 0.3827334), wk = 0.0032468 k( 279) = ( 0.5551843 0.5551843 0.3896315), wk = 0.0032468 k( 280) = ( 0.5517353 0.5517353 0.3965295), wk = 0.0032468 k( 281) = ( 0.5482862 0.5482862 0.4034275), wk = 0.0032468 k( 282) = ( 0.5448372 0.5448372 0.4103256), wk = 0.0032468 k( 283) = ( 0.5413882 0.5413882 0.4172236), wk = 0.0032468 k( 284) = ( 0.5379392 0.5379392 0.4241216), wk = 0.0032468 k( 285) = ( 0.5344902 0.5344902 0.4310197), wk = 0.0032468 k( 286) = ( 0.5310411 0.5310411 0.4379177), wk = 0.0032468 k( 287) = ( 0.5275921 0.5275921 0.4448157), wk = 0.0032468 k( 288) = ( 0.5241431 0.5241431 0.4517138), wk = 0.0032468 k( 289) = ( 0.5206941 0.5206941 0.4586118), wk = 0.0032468 k( 290) = ( 0.5172451 0.5172451 0.4655098), wk = 0.0032468 k( 291) = ( 0.5137961 0.5137961 0.4724079), wk = 0.0032468 k( 292) = ( 0.5103471 0.5103471 0.4793059), wk = 0.0032468 k( 293) = ( 0.5068980 0.5068980 0.4862039), wk = 0.0032468 k( 294) = ( 0.5034490 0.5034490 0.4931020), wk = 0.0032468 k( 295) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 296) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0032468 k( 297) = ( 0.5270173 0.0281580 0.0281580), wk = 0.0032468 k( 298) = ( 0.5540346 0.0563160 0.0563160), wk = 0.0032468 k( 299) = ( 0.5810519 0.0844741 0.0844741), wk = 0.0032468 k( 300) = ( 0.6080692 0.1126321 0.1126321), wk = 0.0032468 k( 301) = ( 0.6350865 0.1407901 0.1407901), wk = 0.0032468 k( 302) = ( 0.6621038 0.1689481 0.1689481), wk = 0.0032468 k( 303) = ( 0.6891211 0.1971061 0.1971061), wk = 0.0032468 k( 304) = ( 0.7161384 0.2252641 0.2252642), wk = 0.0032468 k( 305) = ( 0.7431557 0.2534222 0.2534222), wk = 0.0032468 k( 306) = ( 0.7701729 0.2815802 0.2815802), wk = 0.0032468 k( 307) = ( 0.7971902 0.3097382 0.3097382), wk = 0.0032468 k( 308) = ( 0.8242076 0.3378962 0.3378962), wk = 0.0032468 Dense grid: 76445 G-vectors FFT dimensions: ( 108, 108, 108) Smooth grid: 33791 G-vectors FFT dimensions: ( 80, 80, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.22 Mb ( 254, 58) NL pseudopotentials 0.32 Mb ( 127, 164) Each V/rho on FFT grid 0.53 Mb ( 34992) Each G-vector array 0.02 Mb ( 2123) G-vector shells 0.01 Mb ( 1706) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.90 Mb ( 254, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.29 Mb ( 164, 2, 58) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./YClO.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.7 secs Computing kpt #: 2 total cpu time spent up to now is 7.4 secs Computing kpt #: 3 total cpu time spent up to now is 9.1 secs Computing kpt #: 4 total cpu time spent up to now is 10.8 secs Computing kpt #: 5 total cpu time spent up to now is 12.6 secs Computing kpt #: 6 total cpu time spent up to now is 14.3 secs Computing kpt #: 7 total cpu time spent up to now is 15.9 secs Computing kpt #: 8 total cpu time spent up to now is 17.6 secs Computing kpt #: 9 total cpu time spent up to now is 19.3 secs Computing kpt #: 10 total cpu time spent up to now is 21.0 secs Computing kpt #: 11 total cpu time spent up to now is 22.7 secs Computing kpt #: 12 total cpu time spent up to now is 24.3 secs Computing kpt #: 13 total cpu time spent up to now is 26.0 secs Computing kpt #: 14 total cpu time spent up to now is 27.7 secs Computing kpt #: 15 total cpu time spent up to now is 29.4 secs Computing kpt #: 16 total cpu time spent up to now is 31.1 secs Computing kpt #: 17 total cpu time spent up to now is 32.8 secs Computing kpt #: 18 total cpu time spent up to now is 34.4 secs Computing kpt #: 19 total cpu time spent up to now is 36.1 secs Computing kpt #: 20 total cpu time spent up to now is 37.7 secs Computing kpt #: 21 total cpu time spent up to now is 39.4 secs Computing kpt #: 22 total cpu time spent up to now is 41.0 secs Computing kpt #: 23 total cpu time spent up to now is 42.6 secs Computing kpt #: 24 total cpu time spent up to now is 44.3 secs Computing kpt #: 25 total cpu time spent up to now is 45.7 secs Computing kpt #: 26 total cpu time spent up to now is 47.4 secs Computing kpt #: 27 total cpu time spent up to now is 49.0 secs Computing kpt #: 28 total cpu time spent up to now is 50.7 secs Computing kpt #: 29 total cpu time spent up to now is 52.1 secs Computing kpt #: 30 total cpu time spent up to now is 53.5 secs Computing kpt #: 31 total cpu time spent up to now is 54.9 secs Computing kpt #: 32 total cpu time spent up to now is 56.6 secs Computing kpt #: 33 total cpu time spent up to now is 58.0 secs Computing kpt #: 34 total cpu time spent up to now is 59.4 secs Computing kpt #: 35 total cpu time spent up to now is 61.0 secs Computing kpt #: 36 total cpu time spent up to now is 62.7 secs Computing kpt #: 37 total cpu time spent up to now is 64.3 secs Computing kpt #: 38 total cpu time spent up to now is 66.0 secs Computing kpt #: 39 total cpu time spent up to now is 67.6 secs Computing kpt #: 40 total cpu time spent up to now is 69.3 secs Computing kpt #: 41 total cpu time spent up to now is 71.0 secs Computing kpt #: 42 total cpu time spent up to now is 72.6 secs Computing kpt #: 43 total cpu time spent up to now is 74.3 secs Computing kpt #: 44 total cpu time spent up to now is 75.9 secs Computing kpt #: 45 total cpu time spent up to now is 77.6 secs Computing kpt #: 46 total cpu time spent up to now is 79.3 secs Computing kpt #: 47 total cpu time spent up to now is 81.0 secs Computing kpt #: 48 total cpu time spent up to now is 82.6 secs Computing kpt #: 49 total cpu time spent up to now is 84.3 secs Computing kpt #: 50 total cpu time spent up to now is 86.0 secs Computing kpt #: 51 total cpu time spent up to now is 87.7 secs Computing kpt #: 52 total cpu time spent up to now is 89.4 secs Computing kpt #: 53 total cpu time spent up to now is 91.1 secs Computing kpt #: 54 total cpu time spent up to now is 92.8 secs Computing kpt #: 55 total cpu time spent up to now is 94.5 secs Computing kpt #: 56 total cpu time spent up to now is 96.2 secs Computing kpt #: 57 total cpu time spent up to now is 98.0 secs Computing kpt #: 58 total cpu time spent up to now is 99.6 secs Computing kpt #: 59 total cpu time spent up to now is 101.4 secs Computing kpt #: 60 total cpu time spent up to now is 103.1 secs Computing kpt #: 61 total cpu time spent up to now is 104.8 secs Computing kpt #: 62 total cpu time spent up to now is 106.5 secs Computing kpt #: 63 total cpu time spent up to now is 108.1 secs Computing kpt #: 64 total cpu time spent up to now is 109.8 secs Computing kpt #: 65 total cpu time spent up to now is 111.4 secs Computing kpt #: 66 total cpu time spent up to now is 113.1 secs Computing kpt #: 67 total cpu time spent up to now is 114.8 secs Computing kpt #: 68 total cpu time spent up to now is 116.4 secs Computing kpt #: 69 total cpu time spent up to now is 118.1 secs Computing kpt #: 70 total cpu time spent up to now is 119.8 secs Computing kpt #: 71 total cpu time spent up to now is 121.4 secs Computing kpt #: 72 total cpu time spent up to now is 123.1 secs Computing kpt #: 73 total cpu time spent up to now is 124.8 secs Computing kpt #: 74 total cpu time spent up to now is 126.9 secs Computing kpt #: 75 total cpu time spent up to now is 128.7 secs Computing kpt #: 76 total cpu time spent up to now is 130.3 secs Computing kpt #: 77 total cpu time spent up to now is 132.0 secs Computing kpt #: 78 total cpu time spent up to now is 133.7 secs Computing kpt #: 79 total cpu time spent up to now is 135.4 secs Computing kpt #: 80 total cpu time spent up to now is 137.2 secs Computing kpt #: 81 total cpu time spent up to now is 139.0 secs Computing kpt #: 82 total cpu time spent up to now is 140.7 secs Computing kpt #: 83 total cpu time spent up to now is 142.5 secs Computing kpt #: 84 total cpu time spent up to now is 144.2 secs Computing kpt #: 85 total cpu time spent up to now is 145.9 secs Computing kpt #: 86 total cpu time spent up to now is 147.5 secs Computing kpt #: 87 total cpu time spent up to now is 149.2 secs Computing kpt #: 88 total cpu time spent up to now is 150.8 secs Computing kpt #: 89 total cpu time spent up to now is 152.5 secs Computing kpt #: 90 total cpu time spent up to now is 154.1 secs Computing kpt #: 91 total cpu time spent up to now is 155.8 secs Computing kpt #: 92 total cpu time spent up to now is 157.4 secs Computing kpt #: 93 total cpu time spent up to now is 159.1 secs Computing kpt #: 94 total cpu time spent up to now is 160.7 secs Computing kpt #: 95 total cpu time spent up to now is 162.4 secs Computing kpt #: 96 total cpu time spent up to now is 164.0 secs Computing kpt #: 97 total cpu time spent up to now is 165.7 secs Computing kpt #: 98 total cpu time spent up to now is 167.3 secs Computing kpt #: 99 total cpu time spent up to now is 168.9 secs Computing kpt #: 100 total cpu time spent up to now is 170.6 secs Computing kpt #: 101 total cpu time spent up to now is 172.2 secs Computing kpt #: 102 total cpu time spent up to now is 173.9 secs Computing kpt #: 103 total cpu time spent up to now is 175.5 secs Computing kpt #: 104 total cpu time spent up to now is 177.2 secs Computing kpt #: 105 total cpu time spent up to now is 178.8 secs Computing kpt #: 106 total cpu time spent up to now is 180.4 secs Computing kpt #: 107 total cpu time spent up to now is 182.1 secs Computing kpt #: 108 total cpu time spent up to now is 183.7 secs Computing kpt #: 109 total cpu time spent up to now is 185.3 secs Computing kpt #: 110 total cpu time spent up to now is 187.0 secs Computing kpt #: 111 total cpu time spent up to now is 188.6 secs Computing kpt #: 112 total cpu time spent up to now is 190.2 secs Computing kpt #: 113 total cpu time spent up to now is 191.9 secs Computing kpt #: 114 total cpu time spent up to now is 193.5 secs Computing kpt #: 115 total cpu time spent up to now is 195.1 secs Computing kpt #: 116 total cpu time spent up to now is 196.7 secs Computing kpt #: 117 total cpu time spent up to now is 198.4 secs Computing kpt #: 118 total cpu time spent up to now is 200.0 secs Computing kpt #: 119 total cpu time spent up to now is 201.6 secs Computing kpt #: 120 total cpu time spent up to now is 203.0 secs Computing kpt #: 121 total cpu time spent up to now is 204.7 secs Computing kpt #: 122 total cpu time spent up to now is 206.1 secs Computing kpt #: 123 total cpu time spent up to now is 207.5 secs Computing kpt #: 124 total cpu time spent up to now is 209.2 secs Computing kpt #: 125 total cpu time spent up to now is 210.8 secs Computing kpt #: 126 total cpu time spent up to now is 212.5 secs Computing kpt #: 127 total cpu time spent up to now is 214.2 secs Computing kpt #: 128 total cpu time spent up to now is 215.8 secs Computing kpt #: 129 total cpu time spent up to now is 217.5 secs Computing kpt #: 130 total cpu time spent up to now is 219.2 secs Computing kpt #: 131 total cpu time spent up to now is 220.8 secs Computing kpt #: 132 total cpu time spent up to now is 222.5 secs Computing kpt #: 133 total cpu time spent up to now is 224.2 secs Computing kpt #: 134 total cpu time spent up to now is 225.8 secs Computing kpt #: 135 total cpu time spent up to now is 227.5 secs Computing kpt #: 136 total cpu time spent up to now is 229.1 secs Computing kpt #: 137 total cpu time spent up to now is 231.3 secs Computing kpt #: 138 total cpu time spent up to now is 233.0 secs Computing kpt #: 139 total cpu time spent up to now is 234.6 secs Computing kpt #: 140 total cpu time spent up to now is 236.3 secs Computing kpt #: 141 total cpu time spent up to now is 237.9 secs Computing kpt #: 142 total cpu time spent up to now is 239.6 secs Computing kpt #: 143 total cpu time spent up to now is 241.3 secs Computing kpt #: 144 total cpu time spent up to now is 243.0 secs Computing kpt #: 145 total cpu time spent up to now is 244.7 secs Computing kpt #: 146 total cpu time spent up to now is 246.3 secs Computing kpt #: 147 total cpu time spent up to now is 248.0 secs Computing kpt #: 148 total cpu time spent up to now is 249.7 secs Computing kpt #: 149 total cpu time spent up to now is 251.3 secs Computing kpt #: 150 total cpu time spent up to now is 253.0 secs Computing kpt #: 151 total cpu time spent up to now is 254.7 secs Computing kpt #: 152 total cpu time spent up to now is 256.4 secs Computing kpt #: 153 total cpu time spent up to now is 258.1 secs Computing kpt #: 154 total cpu time spent up to now is 259.7 secs Computing kpt #: 155 total cpu time spent up to now is 261.4 secs Computing kpt #: 156 total cpu time spent up to now is 263.1 secs Computing kpt #: 157 total cpu time spent up to now is 264.8 secs Computing kpt #: 158 total cpu time spent up to now is 266.5 secs Computing kpt #: 159 total cpu time spent up to now is 268.1 secs Computing kpt #: 160 total cpu time spent up to now is 269.8 secs Computing kpt #: 161 total cpu time spent up to now is 271.5 secs Computing kpt #: 162 total cpu time spent up to now is 273.2 secs Computing kpt #: 163 total cpu time spent up to now is 274.9 secs Computing kpt #: 164 total cpu time spent up to now is 276.6 secs Computing kpt #: 165 total cpu time spent up to now is 278.3 secs Computing kpt #: 166 total cpu time spent up to now is 280.0 secs Computing kpt #: 167 total cpu time spent up to now is 281.6 secs Computing kpt #: 168 total cpu time spent up to now is 283.3 secs Computing kpt #: 169 total cpu time spent up to now is 285.3 secs Computing kpt #: 170 total cpu time spent up to now is 287.0 secs Computing kpt #: 171 total cpu time spent up to now is 288.6 secs Computing kpt #: 172 total cpu time spent up to now is 290.3 secs Computing kpt #: 173 total cpu time spent up to now is 292.1 secs Computing kpt #: 174 total cpu time spent up to now is 293.8 secs Computing kpt #: 175 total cpu time spent up to now is 295.6 secs Computing kpt #: 176 total cpu time spent up to now is 297.3 secs Computing kpt #: 177 total cpu time spent up to now is 298.9 secs Computing kpt #: 178 total cpu time spent up to now is 300.6 secs Computing kpt #: 179 total cpu time spent up to now is 302.3 secs Computing kpt #: 180 total cpu time spent up to now is 303.9 secs Computing kpt #: 181 total cpu time spent up to now is 305.6 secs Computing kpt #: 182 total cpu time spent up to now is 307.3 secs Computing kpt #: 183 total cpu time spent up to now is 309.1 secs Computing kpt #: 184 total cpu time spent up to now is 310.8 secs Computing kpt #: 185 total cpu time spent up to now is 312.4 secs Computing kpt #: 186 total cpu time spent up to now is 314.2 secs Computing kpt #: 187 total cpu time spent up to now is 316.0 secs Computing kpt #: 188 total cpu time spent up to now is 317.7 secs Computing kpt #: 189 total cpu time spent up to now is 319.4 secs Computing kpt #: 190 total cpu time spent up to now is 321.2 secs Computing kpt #: 191 total cpu time spent up to now is 322.9 secs Computing kpt #: 192 total cpu time spent up to now is 324.6 secs Computing kpt #: 193 total cpu time spent up to now is 326.3 secs Computing kpt #: 194 total cpu time spent up to now is 328.1 secs Computing kpt #: 195 total cpu time spent up to now is 329.8 secs Computing kpt #: 196 total cpu time spent up to now is 331.6 secs Computing kpt #: 197 total cpu time spent up to now is 333.3 secs Computing kpt #: 198 total cpu time spent up to now is 335.1 secs Computing kpt #: 199 total cpu time spent up to now is 336.8 secs Computing kpt #: 200 total cpu time spent up to now is 338.5 secs Computing kpt #: 201 total cpu time spent up to now is 340.3 secs Computing kpt #: 202 total cpu time spent up to now is 342.0 secs Computing kpt #: 203 total cpu time spent up to now is 343.7 secs Computing kpt #: 204 total cpu time spent up to now is 345.5 secs Computing kpt #: 205 total cpu time spent up to now is 347.2 secs Computing kpt #: 206 total cpu time spent up to now is 348.9 secs Computing kpt #: 207 total cpu time spent up to now is 350.7 secs Computing kpt #: 208 total cpu time spent up to now is 352.4 secs Computing kpt #: 209 total cpu time spent up to now is 354.2 secs Computing kpt #: 210 total cpu time spent up to now is 356.0 secs Computing kpt #: 211 total cpu time spent up to now is 357.7 secs Computing kpt #: 212 total cpu time spent up to now is 359.4 secs Computing kpt #: 213 total cpu time spent up to now is 361.1 secs Computing kpt #: 214 total cpu time spent up to now is 362.8 secs Computing kpt #: 215 total cpu time spent up to now is 364.5 secs Computing kpt #: 216 total cpu time spent up to now is 366.2 secs Computing kpt #: 217 total cpu time spent up to now is 367.8 secs Computing kpt #: 218 total cpu time spent up to now is 369.5 secs Computing kpt #: 219 total cpu time spent up to now is 371.2 secs Computing kpt #: 220 total cpu time spent up to now is 372.9 secs Computing kpt #: 221 total cpu time spent up to now is 374.6 secs Computing kpt #: 222 total cpu time spent up to now is 376.3 secs Computing kpt #: 223 total cpu time spent up to now is 378.2 secs Computing kpt #: 224 total cpu time spent up to now is 379.9 secs Computing kpt #: 225 total cpu time spent up to now is 381.7 secs Computing kpt #: 226 total cpu time spent up to now is 383.4 secs Computing kpt #: 227 total cpu time spent up to now is 385.1 secs Computing kpt #: 228 total cpu time spent up to now is 386.9 secs Computing kpt #: 229 total cpu time spent up to now is 388.6 secs Computing kpt #: 230 total cpu time spent up to now is 390.4 secs Computing kpt #: 231 total cpu time spent up to now is 392.2 secs Computing kpt #: 232 total cpu time spent up to now is 394.0 secs Computing kpt #: 233 total cpu time spent up to now is 395.7 secs Computing kpt #: 234 total cpu time spent up to now is 397.5 secs Computing kpt #: 235 total cpu time spent up to now is 399.2 secs Computing kpt #: 236 total cpu time spent up to now is 401.0 secs Computing kpt #: 237 total cpu time spent up to now is 402.7 secs Computing kpt #: 238 total cpu time spent up to now is 404.8 secs Computing kpt #: 239 total cpu time spent up to now is 406.5 secs Computing kpt #: 240 total cpu time spent up to now is 408.2 secs Computing kpt #: 241 total cpu time spent up to now is 409.9 secs Computing kpt #: 242 total cpu time spent up to now is 412.0 secs Computing kpt #: 243 total cpu time spent up to now is 413.7 secs Computing kpt #: 244 total cpu time spent up to now is 415.8 secs Computing kpt #: 245 total cpu time spent up to now is 417.9 secs Computing kpt #: 246 total cpu time spent up to now is 419.6 secs Computing kpt #: 247 total cpu time spent up to now is 421.3 secs Computing kpt #: 248 total cpu time spent up to now is 423.0 secs Computing kpt #: 249 total cpu time spent up to now is 424.8 secs Computing kpt #: 250 total cpu time spent up to now is 426.5 secs Computing kpt #: 251 total cpu time spent up to now is 428.2 secs Computing kpt #: 252 total cpu time spent up to now is 429.9 secs Computing kpt #: 253 total cpu time spent up to now is 431.6 secs Computing kpt #: 254 total cpu time spent up to now is 433.2 secs Computing kpt #: 255 total cpu time spent up to now is 434.9 secs Computing kpt #: 256 total cpu time spent up to now is 436.5 secs Computing kpt #: 257 total cpu time spent up to now is 438.2 secs Computing kpt #: 258 total cpu time spent up to now is 439.8 secs Computing kpt #: 259 total cpu time spent up to now is 441.5 secs Computing kpt #: 260 total cpu time spent up to now is 443.1 secs Computing kpt #: 261 total cpu time spent up to now is 444.8 secs Computing kpt #: 262 total cpu time spent up to now is 446.4 secs Computing kpt #: 263 total cpu time spent up to now is 448.1 secs Computing kpt #: 264 total cpu time spent up to now is 449.7 secs Computing kpt #: 265 total cpu time spent up to now is 451.2 secs Computing kpt #: 266 total cpu time spent up to now is 452.8 secs Computing kpt #: 267 total cpu time spent up to now is 454.4 secs Computing kpt #: 268 total cpu time spent up to now is 456.1 secs Computing kpt #: 269 total cpu time spent up to now is 457.7 secs Computing kpt #: 270 total cpu time spent up to now is 459.4 secs Computing kpt #: 271 total cpu time spent up to now is 461.0 secs Computing kpt #: 272 total cpu time spent up to now is 462.6 secs Computing kpt #: 273 total cpu time spent up to now is 464.3 secs Computing kpt #: 274 total cpu time spent up to now is 465.9 secs Computing kpt #: 275 total cpu time spent up to now is 467.5 secs Computing kpt #: 276 total cpu time spent up to now is 469.2 secs Computing kpt #: 277 total cpu time spent up to now is 470.8 secs Computing kpt #: 278 total cpu time spent up to now is 472.2 secs Computing kpt #: 279 total cpu time spent up to now is 473.9 secs Computing kpt #: 280 total cpu time spent up to now is 475.3 secs Computing kpt #: 281 total cpu time spent up to now is 476.7 secs Computing kpt #: 282 total cpu time spent up to now is 478.2 secs Computing kpt #: 283 total cpu time spent up to now is 479.8 secs Computing kpt #: 284 total cpu time spent up to now is 481.5 secs Computing kpt #: 285 total cpu time spent up to now is 483.1 secs Computing kpt #: 286 total cpu time spent up to now is 484.8 secs Computing kpt #: 287 total cpu time spent up to now is 486.4 secs Computing kpt #: 288 total cpu time spent up to now is 488.1 secs Computing kpt #: 289 total cpu time spent up to now is 489.8 secs Computing kpt #: 290 total cpu time spent up to now is 491.5 secs Computing kpt #: 291 total cpu time spent up to now is 493.1 secs Computing kpt #: 292 total cpu time spent up to now is 494.8 secs Computing kpt #: 293 total cpu time spent up to now is 496.4 secs Computing kpt #: 294 total cpu time spent up to now is 498.1 secs Computing kpt #: 295 total cpu time spent up to now is 499.8 secs Computing kpt #: 296 total cpu time spent up to now is 501.8 secs Computing kpt #: 297 total cpu time spent up to now is 503.5 secs Computing kpt #: 298 total cpu time spent up to now is 505.2 secs Computing kpt #: 299 total cpu time spent up to now is 506.9 secs Computing kpt #: 300 total cpu time spent up to now is 508.7 secs Computing kpt #: 301 total cpu time spent up to now is 510.4 secs Computing kpt #: 302 total cpu time spent up to now is 512.1 secs Computing kpt #: 303 total cpu time spent up to now is 513.9 secs Computing kpt #: 304 total cpu time spent up to now is 515.6 secs Computing kpt #: 305 total cpu time spent up to now is 517.3 secs Computing kpt #: 306 total cpu time spent up to now is 519.0 secs Computing kpt #: 307 total cpu time spent up to now is 520.7 secs Computing kpt #: 308 total cpu time spent up to now is 522.5 secs ethr = 2.08E-08, avg # of iterations = 24.2 total cpu time spent up to now is 522.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4257 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4151 -15.4151 -15.1337 -15.1337 -14.1626 -14.1626 -13.7496 -13.7496 -13.7220 -13.7220 -13.6698 -13.6698 -10.2978 -10.2978 -10.2264 -10.2264 -7.4178 -7.4178 -7.3606 -7.3606 2.7752 2.7752 2.8077 2.8077 2.8480 2.8480 3.1563 3.1563 3.1736 3.1736 3.8226 3.8226 4.0299 4.0299 5.1880 5.1880 5.2207 5.2207 5.2836 5.2836 5.3153 5.3153 5.5861 5.5861 10.6777 10.6777 11.2805 11.2805 11.2979 11.2979 11.6527 11.6527 11.8986 11.8986 k = 0.0102-0.0243-0.0144 ( 4259 PWs) bands (ev): -34.2439 -34.2439 -34.1928 -34.1928 -15.4153 -15.4153 -15.1340 -15.1340 -14.1629 -14.1629 -13.7510 -13.7510 -13.7216 -13.7216 -13.6703 -13.6703 -10.2967 -10.2967 -10.2251 -10.2251 -7.4179 -7.4179 -7.3605 -7.3605 2.7753 2.7753 2.8077 2.8077 2.8477 2.8477 3.1561 3.1561 3.1736 3.1736 3.8231 3.8231 4.0331 4.0331 5.1863 5.1863 5.2189 5.2189 5.2822 5.2822 5.3136 5.3136 5.5864 5.5864 10.6792 10.6792 11.2804 11.2804 11.2979 11.2979 11.6557 11.6557 11.8908 11.8908 k = 0.0204-0.0486-0.0288 ( 4257 PWs) bands (ev): -34.2438 -34.2438 -34.1927 -34.1927 -15.4157 -15.4157 -15.1350 -15.1350 -14.1638 -14.1638 -13.7548 -13.7548 -13.7204 -13.7204 -13.6718 -13.6718 -10.2933 -10.2933 -10.2213 -10.2213 -7.4180 -7.4180 -7.3604 -7.3604 2.7755 2.7755 2.8081 2.8081 2.8466 2.8466 3.1549 3.1549 3.1745 3.1745 3.8248 3.8248 4.0425 4.0425 5.1811 5.1811 5.2133 5.2133 5.2780 5.2780 5.3089 5.3089 5.5873 5.5873 10.6837 10.6837 11.2797 11.2797 11.2981 11.2981 11.6645 11.6645 11.8758 11.8758 k = 0.0306-0.0730-0.0433 ( 4256 PWs) bands (ev): -34.2436 -34.2436 -34.1926 -34.1926 -15.4165 -15.4165 -15.1366 -15.1366 -14.1652 -14.1652 -13.7606 -13.7606 -13.7192 -13.7192 -13.6743 -13.6743 -10.2877 -10.2877 -10.2151 -10.2151 -7.4182 -7.4182 -7.3601 -7.3601 2.7752 2.7752 2.8092 2.8092 2.8449 2.8449 3.1511 3.1511 3.1782 3.1782 3.8275 3.8275 4.0578 4.0578 5.1725 5.1725 5.2035 5.2035 5.2711 5.2711 5.3017 5.3017 5.5885 5.5885 10.6908 10.6908 11.2776 11.2776 11.2999 11.2999 11.6785 11.6785 11.8624 11.8624 k = 0.0408-0.0973-0.0577 ( 4249 PWs) bands (ev): -34.2432 -34.2432 -34.1924 -34.1924 -15.4176 -15.4176 -15.1388 -15.1388 -14.1672 -14.1672 -13.7678 -13.7678 -13.7182 -13.7182 -13.6775 -13.6775 -10.2799 -10.2799 -10.2065 -10.2065 -7.4184 -7.4184 -7.3597 -7.3597 2.7738 2.7738 2.8116 2.8116 2.8426 2.8426 3.1447 3.1447 3.1851 3.1851 3.8313 3.8313 4.0783 4.0783 5.1599 5.1599 5.1896 5.1896 5.2617 5.2617 5.2931 5.2931 5.5899 5.5899 10.7004 10.7004 11.2739 11.2739 11.3038 11.3038 11.6965 11.6965 11.8544 11.8544 k = 0.0510-0.1216-0.0721 ( 4244 PWs) bands (ev): -34.2428 -34.2428 -34.1922 -34.1922 -15.4189 -15.4189 -15.1417 -15.1417 -14.1698 -14.1698 -13.7764 -13.7764 -13.7180 -13.7180 -13.6813 -13.6813 -10.2700 -10.2700 -10.1956 -10.1956 -7.4187 -7.4187 -7.3591 -7.3591 2.7709 2.7709 2.8158 2.8158 2.8399 2.8399 3.1367 3.1367 3.1949 3.1949 3.8359 3.8359 4.1033 4.1033 5.1428 5.1428 5.1719 5.1719 5.2495 5.2495 5.2843 5.2843 5.5912 5.5912 10.7120 10.7120 11.2690 11.2690 11.3098 11.3098 11.7170 11.7170 11.8544 11.8544 k = 0.0612-0.1459-0.0865 ( 4239 PWs) bands (ev): -34.2423 -34.2423 -34.1919 -34.1919 -15.4206 -15.4206 -15.1453 -15.1453 -14.1729 -14.1729 -13.7861 -13.7861 -13.7188 -13.7188 -13.6853 -13.6853 -10.2580 -10.2580 -10.1824 -10.1824 -7.4191 -7.4191 -7.3585 -7.3585 2.7662 2.7662 2.8218 2.8218 2.8370 2.8370 3.1279 3.1279 3.2071 3.2071 3.8411 3.8411 4.1319 4.1319 5.1199 5.1199 5.1520 5.1520 5.2349 5.2349 5.2757 5.2757 5.5921 5.5921 10.7252 10.7252 11.2638 11.2638 11.3174 11.3174 11.7377 11.7377 11.8647 11.8647 k = 0.0714-0.1703-0.1010 ( 4236 PWs) bands (ev): -34.2417 -34.2417 -34.1916 -34.1916 -15.4227 -15.4227 -15.1495 -15.1495 -14.1766 -14.1766 -13.7968 -13.7968 -13.7209 -13.7209 -13.6892 -13.6892 -10.2441 -10.2441 -10.1672 -10.1672 -7.4194 -7.4194 -7.3577 -7.3577 2.7599 2.7599 2.8281 2.8281 2.8354 2.8354 3.1190 3.1190 3.2217 3.2217 3.8465 3.8465 4.1636 4.1636 5.0904 5.0904 5.1310 5.1310 5.2186 5.2186 5.2674 5.2674 5.5924 5.5924 10.7393 10.7393 11.2589 11.2589 11.3266 11.3266 11.7570 11.7570 11.8868 11.8868 k = 0.0816-0.1946-0.1154 ( 4240 PWs) bands (ev): -34.2409 -34.2409 -34.1912 -34.1912 -15.4250 -15.4250 -15.1543 -15.1543 -14.1809 -14.1809 -13.8085 -13.8085 -13.7247 -13.7247 -13.6924 -13.6924 -10.2283 -10.2283 -10.1500 -10.1500 -7.4197 -7.4197 -7.3567 -7.3567 2.7521 2.7521 2.8281 2.8281 2.8419 2.8419 3.1105 3.1105 3.2385 3.2385 3.8517 3.8517 4.1975 4.1975 5.0545 5.0545 5.1096 5.1096 5.2010 5.2010 5.2590 5.2590 5.5919 5.5919 10.7539 10.7539 11.2550 11.2550 11.3372 11.3372 11.7752 11.7752 11.9201 11.9201 k = 0.0918-0.2189-0.1298 ( 4236 PWs) bands (ev): -34.2402 -34.2402 -34.1908 -34.1908 -15.4277 -15.4277 -15.1598 -15.1598 -14.1857 -14.1857 -13.8211 -13.8211 -13.7301 -13.7301 -13.6949 -13.6949 -10.2108 -10.2108 -10.1310 -10.1310 -7.4200 -7.4200 -7.3556 -7.3556 2.7430 2.7430 2.8253 2.8253 2.8530 2.8530 3.1029 3.1029 3.2575 3.2575 3.8563 3.8563 4.2330 4.2330 5.0131 5.0131 5.0878 5.0878 5.1826 5.1826 5.2503 5.2503 5.5906 5.5906 10.7682 10.7682 11.2526 11.2526 11.3490 11.3490 11.7938 11.7938 11.9628 11.9628 k = 0.1020-0.2432-0.1442 ( 4236 PWs) bands (ev): -34.2393 -34.2393 -34.1904 -34.1904 -15.4307 -15.4307 -15.1659 -15.1659 -14.1911 -14.1911 -13.8346 -13.8346 -13.7369 -13.7369 -13.6967 -13.6967 -10.1917 -10.1917 -10.1104 -10.1104 -7.4202 -7.4202 -7.3543 -7.3543 2.7327 2.7327 2.8227 2.8227 2.8659 2.8659 3.0965 3.0965 3.2785 3.2785 3.8598 3.8598 4.2694 4.2694 4.9671 4.9671 5.0662 5.0662 5.1636 5.1636 5.2411 5.2411 5.5882 5.5882 10.7817 10.7817 11.2521 11.2521 11.3620 11.3620 11.8145 11.8145 12.0126 12.0126 k = 0.1122-0.2675-0.1586 ( 4234 PWs) bands (ev): -34.2383 -34.2383 -34.1899 -34.1899 -15.4340 -15.4340 -15.1727 -15.1727 -14.1970 -14.1970 -13.8487 -13.8487 -13.7447 -13.7447 -13.6982 -13.6982 -10.1711 -10.1711 -10.0882 -10.0882 -7.4203 -7.4203 -7.3528 -7.3528 2.7213 2.7213 2.8206 2.8206 2.8803 2.8803 3.0913 3.0913 3.3016 3.3016 3.8616 3.8616 4.3061 4.3061 4.9174 4.9174 5.0450 5.0450 5.1442 5.1442 5.2313 5.2313 5.5847 5.5847 10.7939 10.7939 11.2541 11.2541 11.3761 11.3761 11.8380 11.8380 12.0678 12.0678 k = 0.1224-0.2919-0.1731 ( 4230 PWs) bands (ev): -34.2373 -34.2373 -34.1894 -34.1894 -15.4376 -15.4376 -15.1801 -15.1801 -14.2034 -14.2034 -13.8636 -13.8636 -13.7531 -13.7531 -13.6993 -13.6993 -10.1492 -10.1492 -10.0648 -10.0648 -7.4203 -7.4203 -7.3511 -7.3511 2.7091 2.7091 2.8195 2.8195 2.8960 2.8960 3.0876 3.0876 3.3265 3.3265 3.8614 3.8614 4.3424 4.3424 4.8646 4.8646 5.0250 5.0250 5.1244 5.1244 5.2209 5.2209 5.5801 5.5801 10.8044 10.8044 11.2587 11.2587 11.3911 11.3911 11.8648 11.8648 12.1258 12.1258 k = 0.1327-0.3162-0.1875 ( 4231 PWs) bands (ev): -34.2362 -34.2362 -34.1888 -34.1888 -15.4416 -15.4416 -15.1881 -15.1881 -14.2103 -14.2103 -13.8790 -13.8790 -13.7620 -13.7620 -13.7004 -13.7004 -10.1261 -10.1261 -10.0402 -10.0402 -7.4201 -7.4201 -7.3492 -7.3492 2.6962 2.6962 2.8195 2.8195 2.9129 2.9129 3.0851 3.0851 3.3533 3.3533 3.8586 3.8586 4.3777 4.3777 4.8095 4.8095 5.0067 5.0067 5.1043 5.1043 5.2098 5.2098 5.5744 5.5744 10.8130 10.8130 11.2661 11.2661 11.4070 11.4070 11.8948 11.8948 12.1745 12.1745 k = 0.1429-0.3405-0.2019 ( 4228 PWs) bands (ev): -34.2350 -34.2350 -34.1883 -34.1883 -15.4459 -15.4459 -15.1967 -15.1967 -14.2176 -14.2176 -13.8950 -13.8950 -13.7709 -13.7709 -13.7015 -13.7015 -10.1019 -10.1019 -10.0146 -10.0146 -7.4198 -7.4198 -7.3471 -7.3471 2.6829 2.6829 2.8207 2.8207 2.9310 2.9310 3.0839 3.0839 3.3819 3.3819 3.8529 3.8529 4.4111 4.4111 4.7531 4.7531 4.9906 4.9906 5.0839 5.0839 5.1982 5.1982 5.5675 5.5675 10.8196 10.8196 11.2763 11.2763 11.4237 11.4237 11.9278 11.9278 12.2070 12.2070 k = 0.1531-0.3648-0.2163 ( 4236 PWs) bands (ev): -34.2338 -34.2338 -34.1877 -34.1877 -15.4506 -15.4506 -15.2060 -15.2060 -14.2254 -14.2254 -13.9114 -13.9114 -13.7799 -13.7799 -13.7026 -13.7026 -10.0770 -10.0770 -9.9883 -9.9883 -7.4192 -7.4192 -7.3447 -7.3447 2.6694 2.6694 2.8234 2.8234 2.9502 2.9502 3.0839 3.0839 3.4121 3.4121 3.8441 3.8441 4.4412 4.4412 4.6967 4.6967 4.9769 4.9769 5.0635 5.0635 5.1860 5.1860 5.5595 5.5595 10.8243 10.8243 11.2891 11.2891 11.4410 11.4410 11.9635 11.9635 12.2373 12.2373 k = 0.1633-0.3891-0.2307 ( 4228 PWs) bands (ev): -34.2325 -34.2325 -34.1871 -34.1871 -15.4555 -15.4555 -15.2158 -15.2158 -14.2334 -14.2334 -13.9281 -13.9281 -13.7887 -13.7887 -13.7037 -13.7037 -10.0513 -10.0513 -9.9614 -9.9614 -7.4183 -7.4183 -7.3420 -7.3420 2.6557 2.6557 2.8275 2.8275 2.9703 2.9703 3.0850 3.0850 3.4439 3.4439 3.8319 3.8319 4.4651 4.4651 4.6435 4.6435 4.9657 4.9657 5.0435 5.0435 5.1733 5.1733 5.5504 5.5504 10.8273 10.8273 11.3043 11.3043 11.4590 11.4590 12.0014 12.0014 12.2679 12.2679 k = 0.1735-0.4135-0.2452 ( 4219 PWs) bands (ev): -34.2311 -34.2311 -34.1864 -34.1864 -15.4608 -15.4608 -15.2262 -15.2262 -14.2417 -14.2417 -13.9452 -13.9452 -13.7972 -13.7972 -13.7049 -13.7049 -10.0250 -10.0250 -9.9340 -9.9340 -7.4171 -7.4171 -7.3391 -7.3391 2.6421 2.6421 2.8333 2.8333 2.9914 2.9914 3.0871 3.0871 3.4773 3.4773 3.8164 3.8164 4.4744 4.4744 4.6019 4.6019 4.9564 4.9564 5.0246 5.0246 5.1602 5.1602 5.5402 5.5402 10.8288 10.8288 11.3215 11.3215 11.4774 11.4774 12.0410 12.0410 12.2991 12.2991 k = 0.1837-0.4378-0.2596 ( 4212 PWs) bands (ev): -34.2297 -34.2297 -34.1858 -34.1858 -15.4664 -15.4664 -15.2372 -15.2372 -14.2503 -14.2503 -13.9624 -13.9624 -13.8053 -13.8053 -13.7062 -13.7062 -9.9984 -9.9984 -9.9064 -9.9064 -7.4156 -7.4156 -7.3358 -7.3358 2.6287 2.6287 2.8406 2.8406 3.0131 3.0131 3.0901 3.0901 3.5120 3.5120 3.7977 3.7977 4.4542 4.4542 4.5873 4.5873 4.9474 4.9474 5.0084 5.0084 5.1468 5.1468 5.5290 5.5290 10.8290 10.8290 11.3404 11.3404 11.4963 11.4963 12.0816 12.0816 12.3309 12.3309 k = 0.1939-0.4621-0.2740 ( 4203 PWs) bands (ev): -34.2282 -34.2282 -34.1851 -34.1851 -15.4723 -15.4723 -15.2487 -15.2487 -14.2590 -14.2590 -13.9797 -13.9797 -13.8130 -13.8130 -13.7075 -13.7075 -9.9715 -9.9715 -9.8787 -9.8787 -7.4137 -7.4137 -7.3323 -7.3323 2.6153 2.6153 2.8497 2.8497 3.0354 3.0354 3.0940 3.0940 3.5480 3.5480 3.7761 3.7761 4.4086 4.4086 4.5957 4.5957 4.9365 4.9365 4.9971 4.9971 5.1331 5.1331 5.5167 5.5167 10.8283 10.8283 11.3605 11.3605 11.5154 11.5154 12.1226 12.1226 12.3632 12.3632 k = 0.2041-0.4864-0.2884 ( 4207 PWs) bands (ev): -34.2267 -34.2267 -34.1844 -34.1844 -15.4784 -15.4784 -15.2606 -15.2606 -14.2678 -14.2678 -13.9971 -13.9971 -13.8203 -13.8203 -13.7090 -13.7090 -9.9445 -9.9445 -9.8510 -9.8510 -7.4115 -7.4115 -7.3285 -7.3285 2.6021 2.6021 2.8604 2.8604 3.0577 3.0577 3.0993 3.0993 3.5852 3.5852 3.7517 3.7517 4.3539 4.3539 4.6116 4.6116 4.9215 4.9215 4.9921 4.9921 5.1193 5.1193 5.5035 5.5035 10.8266 10.8266 11.3815 11.3815 11.5348 11.5348 12.1633 12.1633 12.3958 12.3958 k = 0.2143-0.5108-0.3029 ( 4203 PWs) bands (ev): -34.2252 -34.2252 -34.1837 -34.1837 -15.4848 -15.4848 -15.2730 -15.2730 -14.2766 -14.2766 -14.0144 -14.0144 -13.8270 -13.8270 -13.7105 -13.7105 -9.9175 -9.9175 -9.8236 -9.8236 -7.4089 -7.4089 -7.3243 -7.3243 2.5890 2.5890 2.8727 2.8727 3.0787 3.0787 3.1069 3.1069 3.6234 3.6234 3.7251 3.7251 4.2967 4.2967 4.6286 4.6286 4.9030 4.9030 4.9926 4.9926 5.1055 5.1055 5.4893 5.4893 10.8242 10.8242 11.4031 11.4031 11.5544 11.5544 12.2031 12.2031 12.4287 12.4287 k = 0.2245-0.5351-0.3173 ( 4207 PWs) bands (ev): -34.2236 -34.2236 -34.1830 -34.1830 -15.4914 -15.4914 -15.2858 -15.2858 -14.2854 -14.2854 -14.0316 -14.0316 -13.8332 -13.8332 -13.7121 -13.7121 -9.8907 -9.8907 -9.7965 -9.7965 -7.4058 -7.4058 -7.3199 -7.3199 2.5758 2.5758 2.8866 2.8866 3.0949 3.0949 3.1204 3.1204 3.6626 3.6626 3.6966 3.6966 4.2397 4.2397 4.6448 4.6448 4.8824 4.8824 4.9962 4.9962 5.0920 5.0920 5.4742 5.4742 10.8212 10.8212 11.4249 11.4249 11.5740 11.5740 12.2414 12.2414 12.4616 12.4616 k = 0.2347-0.5594-0.3317 ( 4211 PWs) bands (ev): -34.2220 -34.2220 -34.1824 -34.1824 -15.4982 -15.4982 -15.2990 -15.2990 -14.2940 -14.2940 -14.0486 -14.0486 -13.8388 -13.8388 -13.7138 -13.7138 -9.8641 -9.8641 -9.7699 -9.7699 -7.4023 -7.4023 -7.3151 -7.3151 2.5625 2.5625 2.9021 2.9021 3.1049 3.1049 3.1410 3.1410 3.6665 3.6665 3.7027 3.7027 4.1842 4.1842 4.6596 4.6596 4.8608 4.8608 5.0011 5.0011 5.0791 5.0791 5.4584 5.4584 10.8175 10.8175 11.4466 11.4466 11.5937 11.5937 12.2776 12.2776 12.4946 12.4946 k = 0.2449-0.5837-0.3461 ( 4215 PWs) bands (ev): -34.2204 -34.2204 -34.1817 -34.1817 -15.5051 -15.5051 -15.3125 -15.3125 -14.3025 -14.3025 -14.0654 -14.0654 -13.8440 -13.8440 -13.7156 -13.7156 -9.8379 -9.8379 -9.7439 -9.7439 -7.3983 -7.3983 -7.3101 -7.3101 2.5489 2.5489 2.9190 2.9190 3.1125 3.1125 3.1648 3.1648 3.6353 3.6353 3.7433 3.7433 4.1311 4.1311 4.6728 4.6728 4.8389 4.8389 5.0052 5.0052 5.0677 5.0677 5.4417 5.4417 10.8131 10.8131 11.4679 11.4679 11.6133 11.6133 12.3110 12.3110 12.5274 12.5274 k = 0.2551-0.6080-0.3605 ( 4219 PWs) bands (ev): -34.2188 -34.2188 -34.1810 -34.1810 -15.5122 -15.5122 -15.3263 -15.3263 -14.3107 -14.3107 -14.0819 -14.0819 -13.8485 -13.8485 -13.7174 -13.7174 -9.8122 -9.8122 -9.7187 -9.7187 -7.3939 -7.3939 -7.3048 -7.3048 2.5348 2.5348 2.9371 2.9371 3.1198 3.1198 3.1897 3.1897 3.6032 3.6032 3.7846 3.7846 4.0812 4.0812 4.6841 4.6841 4.8173 4.8173 5.0065 5.0065 5.0590 5.0590 5.4244 5.4244 10.8079 10.8079 11.4886 11.4886 11.6328 11.6328 12.3413 12.3413 12.5599 12.5599 k = 0.2653-0.6324-0.3750 ( 4220 PWs) bands (ev): -34.2171 -34.2171 -34.1804 -34.1804 -15.5194 -15.5194 -15.3402 -15.3402 -14.3186 -14.3186 -14.0980 -14.0980 -13.8526 -13.8526 -13.7193 -13.7193 -9.7871 -9.7871 -9.6943 -9.6943 -7.3890 -7.3890 -7.2992 -7.2992 2.5201 2.5201 2.9563 2.9563 3.1274 3.1274 3.2151 3.2151 3.5702 3.5702 3.8262 3.8262 4.0352 4.0352 4.6930 4.6930 4.7965 4.7965 5.0030 5.0030 5.0544 5.0544 5.4065 5.4065 10.8017 10.8017 11.5085 11.5085 11.6522 11.6522 12.3681 12.3681 12.5921 12.5921 k = 0.2755-0.6567-0.3894 ( 4214 PWs) bands (ev): -34.2155 -34.2155 -34.1798 -34.1798 -15.5267 -15.5267 -15.3543 -15.3543 -14.3261 -14.3261 -14.1137 -14.1137 -13.8562 -13.8562 -13.7213 -13.7213 -9.7627 -9.7627 -9.6708 -9.6708 -7.3837 -7.3837 -7.2935 -7.2935 2.5047 2.5047 2.9763 2.9763 3.1356 3.1356 3.2407 3.2407 3.5365 3.5365 3.8679 3.8679 3.9940 3.9940 4.6987 4.6987 4.7777 4.7777 4.9948 4.9948 5.0533 5.0533 5.3880 5.3880 10.7943 10.7943 11.5274 11.5274 11.6714 11.6714 12.3911 12.3911 12.6240 12.6240 k = 0.2857-0.6810-0.4038 ( 4213 PWs) bands (ev): -34.2138 -34.2138 -34.1791 -34.1791 -15.5339 -15.5339 -15.3685 -15.3685 -14.3333 -14.3333 -14.1290 -14.1290 -13.8592 -13.8592 -13.7233 -13.7233 -9.7389 -9.7389 -9.6483 -9.6483 -7.3780 -7.3780 -7.2875 -7.2875 2.4883 2.4883 2.9968 2.9968 3.1449 3.1449 3.2663 3.2663 3.5021 3.5021 3.9088 3.9088 3.9589 3.9589 4.6992 4.6992 4.7630 4.7630 4.9835 4.9835 5.0537 5.0537 5.3691 5.3691 10.7856 10.7856 11.5452 11.5452 11.6903 11.6903 12.4103 12.4103 12.6554 12.6554 k = 0.2959-0.7053-0.4182 ( 4211 PWs) bands (ev): -34.2122 -34.2122 -34.1786 -34.1786 -15.5411 -15.5411 -15.3827 -15.3827 -14.3401 -14.3401 -14.1438 -14.1438 -13.8619 -13.8619 -13.7253 -13.7253 -9.7160 -9.7160 -9.6270 -9.6270 -7.3719 -7.3719 -7.2814 -7.2814 2.4710 2.4710 3.0174 3.0174 3.1553 3.1553 3.2916 3.2916 3.4673 3.4673 3.9224 3.9224 3.9569 3.9569 4.6921 4.6921 4.7547 4.7547 4.9707 4.9707 5.0538 5.0538 5.3498 5.3498 10.7753 10.7753 11.5619 11.5619 11.7089 11.7089 12.4258 12.4258 12.6863 12.6863 k = 0.3061-0.7297-0.4326 ( 4222 PWs) bands (ev): -34.2105 -34.2105 -34.1780 -34.1780 -15.5483 -15.5483 -15.3969 -15.3969 -14.3465 -14.3465 -14.1581 -14.1581 -13.8641 -13.8641 -13.7275 -13.7275 -9.6939 -9.6939 -9.6067 -9.6067 -7.3654 -7.3654 -7.2752 -7.2752 2.4527 2.4527 3.0378 3.0378 3.1672 3.1672 3.3163 3.3163 3.4323 3.4323 3.8997 3.8997 3.9968 3.9968 4.6783 4.6783 4.7522 4.7522 4.9572 4.9572 5.0528 5.0528 5.3303 5.3303 10.7634 10.7634 11.5775 11.5775 11.7272 11.7272 12.4377 12.4377 12.7166 12.7166 k = 0.3163-0.7540-0.4471 ( 4220 PWs) bands (ev): -34.2089 -34.2089 -34.1775 -34.1775 -15.5553 -15.5553 -15.4109 -15.4109 -14.3524 -14.3524 -14.1718 -14.1718 -13.8659 -13.8659 -13.7296 -13.7296 -9.6727 -9.6727 -9.5877 -9.5877 -7.3586 -7.3586 -7.2689 -7.2689 2.4334 2.4334 3.0575 3.0575 3.1807 3.1807 3.3393 3.3393 3.3989 3.3989 3.8809 3.8809 4.0384 4.0384 4.6608 4.6608 4.7522 4.7522 4.9433 4.9433 5.0502 5.0502 5.3106 5.3106 10.7496 10.7496 11.5921 11.5921 11.7451 11.7451 12.4463 12.4463 12.7465 12.7465 k = 0.3265-0.7783-0.4615 ( 4222 PWs) bands (ev): -34.2073 -34.2073 -34.1770 -34.1770 -15.5621 -15.5621 -15.4247 -15.4247 -14.3578 -14.3578 -14.1850 -14.1850 -13.8673 -13.8673 -13.7318 -13.7318 -9.6524 -9.6524 -9.5699 -9.5699 -7.3515 -7.3515 -7.2626 -7.2626 2.4133 2.4133 3.0762 3.0762 3.1955 3.1955 3.3480 3.3480 3.3798 3.3798 3.8678 3.8678 4.0798 4.0798 4.6418 4.6418 4.7526 4.7526 4.9292 4.9292 5.0460 5.0460 5.2908 5.2908 10.7341 10.7341 11.6057 11.6057 11.7626 11.7626 12.4520 12.4520 12.7756 12.7756 k = 0.3367-0.8026-0.4759 ( 4226 PWs) bands (ev): -34.2058 -34.2058 -34.1765 -34.1765 -15.5687 -15.5687 -15.4383 -15.4383 -14.3628 -14.3628 -14.1976 -14.1976 -13.8683 -13.8683 -13.7340 -13.7340 -9.6331 -9.6331 -9.5534 -9.5534 -7.3442 -7.3442 -7.2563 -7.2563 2.3925 2.3925 3.0935 3.0935 3.2105 3.2105 3.3235 3.3235 3.3957 3.3957 3.8601 3.8601 4.1209 4.1209 4.6225 4.6225 4.7521 4.7521 4.9149 4.9149 5.0403 5.0403 5.2709 5.2709 10.7167 10.7167 11.6186 11.6186 11.7796 11.7796 12.4553 12.4553 12.8041 12.8041 k = 0.3469-0.8269-0.4903 ( 4230 PWs) bands (ev): -34.2042 -34.2042 -34.1761 -34.1761 -15.5751 -15.5751 -15.4516 -15.4516 -14.3673 -14.3673 -14.2096 -14.2096 -13.8691 -13.8691 -13.7362 -13.7362 -9.6147 -9.6147 -9.5382 -9.5382 -7.3367 -7.3367 -7.2502 -7.2502 2.3712 2.3712 3.1089 3.1089 3.2224 3.2224 3.2983 3.2983 3.4176 3.4176 3.8575 3.8575 4.1614 4.1614 4.6032 4.6032 4.7502 4.7502 4.9006 4.9006 5.0333 5.0333 5.2511 5.2511 10.6977 10.6977 11.6308 11.6308 11.7961 11.7961 12.4565 12.4565 12.8315 12.8315 k = 0.3571-0.8513-0.5048 ( 4231 PWs) bands (ev): -34.2028 -34.2028 -34.1757 -34.1757 -15.5811 -15.5811 -15.4644 -15.4644 -14.3714 -14.3714 -14.2210 -14.2210 -13.8696 -13.8696 -13.7384 -13.7384 -9.5974 -9.5974 -9.5242 -9.5242 -7.3291 -7.3291 -7.2442 -7.2442 2.3497 2.3497 3.1213 3.1213 3.2228 3.2228 3.2880 3.2880 3.4397 3.4397 3.8598 3.8598 4.2012 4.2012 4.5845 4.5845 4.7465 4.7465 4.8863 4.8863 5.0253 5.0253 5.2313 5.2313 10.6773 10.6773 11.6423 11.6423 11.8120 11.8120 12.4562 12.4562 12.8575 12.8575 k = 0.3673-0.8756-0.5192 ( 4231 PWs) bands (ev): -34.2013 -34.2013 -34.1754 -34.1754 -15.5868 -15.5868 -15.4769 -15.4769 -14.3750 -14.3750 -14.2317 -14.2317 -13.8698 -13.8698 -13.7406 -13.7406 -9.5810 -9.5810 -9.5116 -9.5116 -7.3216 -7.3216 -7.2383 -7.2383 2.3282 2.3282 3.1276 3.1276 3.2112 3.2112 3.2965 3.2965 3.4611 3.4611 3.8664 3.8664 4.2401 4.2401 4.5663 4.5663 4.7409 4.7409 4.8718 4.8718 5.0166 5.0166 5.2118 5.2118 10.6557 10.6557 11.6533 11.6533 11.8273 11.8273 12.4545 12.4545 12.8813 12.8813 k = 0.3776-0.8999-0.5336 ( 4233 PWs) bands (ev): -34.2000 -34.2000 -34.1751 -34.1751 -15.5921 -15.5921 -15.4888 -15.4888 -14.3781 -14.3781 -14.2418 -14.2418 -13.8698 -13.8698 -13.7428 -13.7428 -9.5656 -9.5656 -9.5002 -9.5002 -7.3140 -7.3140 -7.2328 -7.2328 2.3071 2.3071 3.1225 3.1225 3.2039 3.2039 3.3131 3.3131 3.4817 3.4817 3.8769 3.8769 4.2780 4.2780 4.5490 4.5490 4.7330 4.7330 4.8573 4.8573 5.0076 5.0076 5.1925 5.1925 10.6333 10.6333 11.6637 11.6637 11.8419 11.8419 12.4519 12.4519 12.9014 12.9014 k = 0.3878-0.9242-0.5480 ( 4232 PWs) bands (ev): -34.1987 -34.1987 -34.1748 -34.1748 -15.5970 -15.5970 -15.5001 -15.5001 -14.3809 -14.3809 -14.2512 -14.2512 -13.8696 -13.8696 -13.7449 -13.7449 -9.5513 -9.5513 -9.4901 -9.4901 -7.3067 -7.3067 -7.2275 -7.2275 2.2865 2.2865 3.1055 3.1055 3.2072 3.2072 3.3318 3.3318 3.5012 3.5012 3.8910 3.8910 4.3148 4.3148 4.5325 4.5325 4.7229 4.7229 4.8425 4.8425 4.9986 4.9986 5.1737 5.1737 10.6106 10.6106 11.6735 11.6735 11.8558 11.8558 12.4487 12.4487 12.9165 12.9165 k = 0.3980-0.9485-0.5624 ( 4234 PWs) bands (ev): -34.1975 -34.1975 -34.1746 -34.1746 -15.6014 -15.6014 -15.5108 -15.5108 -14.3832 -14.3832 -14.2600 -14.2600 -13.8693 -13.8693 -13.7469 -13.7469 -9.5379 -9.5379 -9.4813 -9.4813 -7.2995 -7.2995 -7.2226 -7.2226 2.2667 2.2667 3.0828 3.0828 3.2168 3.2168 3.3505 3.3505 3.5195 3.5195 3.9080 3.9080 4.3503 4.3503 4.5172 4.5172 4.7106 4.7106 4.8275 4.8275 4.9898 4.9898 5.1555 5.1555 10.5880 10.5880 11.6826 11.6826 11.8688 11.8688 12.4450 12.4450 12.9274 12.9274 k = 0.4082-0.9729-0.5769 ( 4234 PWs) bands (ev): -34.1963 -34.1963 -34.1745 -34.1745 -15.6054 -15.6054 -15.5208 -15.5208 -14.3852 -14.3852 -14.2680 -14.2680 -13.8688 -13.8688 -13.7489 -13.7489 -9.5256 -9.5256 -9.4737 -9.4737 -7.2926 -7.2926 -7.2181 -7.2181 2.2480 2.2480 3.0589 3.0589 3.2287 3.2287 3.3684 3.3684 3.5365 3.5365 3.9276 3.9276 4.3842 4.3842 4.5033 4.5033 4.6964 4.6964 4.8122 4.8122 4.9815 4.9815 5.1383 5.1383 10.5658 10.5658 11.6910 11.6910 11.8810 11.8810 12.4412 12.4412 12.9362 12.9362 k = 0.4184-0.9972-0.5913 ( 4227 PWs) bands (ev): -34.1953 -34.1953 -34.1743 -34.1743 -15.6089 -15.6089 -15.5301 -15.5301 -14.3868 -14.3868 -14.2753 -14.2753 -13.8683 -13.8683 -13.7507 -13.7507 -9.5142 -9.5142 -9.4673 -9.4673 -7.2862 -7.2862 -7.2140 -7.2140 2.2307 2.2307 3.0360 3.0360 3.2413 3.2413 3.3849 3.3849 3.5520 3.5520 3.9491 3.9491 4.4158 4.4158 4.4915 4.4915 4.6806 4.6806 4.7965 4.7965 4.9736 4.9736 5.1222 5.1222 10.5447 10.5447 11.6985 11.6985 11.8921 11.8921 12.4372 12.4372 12.9443 12.9443 k = 0.4286-1.0215-0.6057 ( 4225 PWs) bands (ev): -34.1943 -34.1943 -34.1742 -34.1742 -15.6118 -15.6118 -15.5385 -15.5385 -14.3881 -14.3881 -14.2819 -14.2819 -13.8677 -13.8677 -13.7524 -13.7524 -9.5038 -9.5038 -9.4622 -9.4622 -7.2802 -7.2802 -7.2103 -7.2103 2.2150 2.2150 3.0148 3.0148 3.2536 3.2536 3.3998 3.3998 3.5660 3.5660 3.9719 3.9719 4.4420 4.4420 4.4849 4.4849 4.6636 4.6636 4.7804 4.7804 4.9663 4.9663 5.1075 5.1075 10.5250 10.5250 11.7052 11.7052 11.9022 11.9022 12.4334 12.4334 12.9523 12.9523 k = 0.4388-1.0458-0.6201 ( 4225 PWs) bands (ev): -34.1934 -34.1934 -34.1741 -34.1741 -15.6143 -15.6143 -15.5460 -15.5460 -14.3891 -14.3891 -14.2876 -14.2876 -13.8671 -13.8671 -13.7539 -13.7539 -9.4945 -9.4945 -9.4581 -9.4581 -7.2749 -7.2749 -7.2071 -7.2071 2.2009 2.2009 2.9959 2.9959 3.2652 3.2652 3.4128 3.4128 3.5784 3.5784 3.9951 3.9951 4.4517 4.4517 4.4945 4.4945 4.6461 4.6461 4.7638 4.7638 4.9595 4.9595 5.0946 5.0946 10.5070 10.5070 11.7110 11.7110 11.9111 11.9111 12.4299 12.4299 12.9604 12.9604 k = 0.4490-1.0702-0.6345 ( 4223 PWs) bands (ev): -34.1927 -34.1927 -34.1741 -34.1741 -15.6163 -15.6163 -15.5526 -15.5526 -14.3898 -14.3898 -14.2926 -14.2926 -13.8665 -13.8665 -13.7553 -13.7553 -9.4861 -9.4861 -9.4552 -9.4552 -7.2701 -7.2701 -7.2045 -7.2045 2.1888 2.1888 2.9796 2.9796 3.2757 3.2757 3.4239 3.4239 3.5890 3.5890 4.0179 4.0179 4.4472 4.4472 4.5182 4.5182 4.6288 4.6288 4.7467 4.7467 4.9533 4.9533 5.0835 5.0835 10.4912 10.4912 11.7159 11.7159 11.9188 11.9188 12.4267 12.4267 12.9683 12.9683 k = 0.4592-1.0945-0.6490 ( 4223 PWs) bands (ev): -34.1921 -34.1921 -34.1740 -34.1740 -15.6178 -15.6178 -15.5581 -15.5581 -14.3904 -14.3904 -14.2967 -14.2967 -13.8660 -13.8660 -13.7564 -13.7564 -9.4788 -9.4788 -9.4534 -9.4534 -7.2661 -7.2661 -7.2023 -7.2023 2.1786 2.1786 2.9660 2.9660 3.2847 3.2847 3.4330 3.4330 3.5979 3.5979 4.0391 4.0391 4.4404 4.4404 4.5442 4.5442 4.6126 4.6126 4.7290 4.7290 4.9479 4.9479 5.0744 5.0744 10.4779 10.4779 11.7198 11.7198 11.9252 11.9252 12.4239 12.4239 12.9757 12.9757 k = 0.4694-1.1188-0.6634 ( 4219 PWs) bands (ev): -34.1916 -34.1916 -34.1740 -34.1740 -15.6189 -15.6189 -15.5625 -15.5625 -14.3907 -14.3907 -14.3000 -14.3000 -13.8656 -13.8656 -13.7573 -13.7573 -9.4725 -9.4725 -9.4525 -9.4525 -7.2629 -7.2629 -7.2006 -7.2006 2.1706 2.1706 2.9553 2.9553 3.2920 3.2920 3.4401 3.4401 3.6048 3.6048 4.0576 4.0576 4.4340 4.4340 4.5694 4.5694 4.5985 4.5985 4.7109 4.7109 4.9433 4.9433 5.0674 5.0674 10.4672 10.4672 11.7228 11.7228 11.9303 11.9303 12.4217 12.4217 12.9821 12.9821 k = 0.4796-1.1431-0.6778 ( 4218 PWs) bands (ev): -34.1912 -34.1912 -34.1740 -34.1740 -15.6197 -15.6197 -15.5658 -15.5658 -14.3910 -14.3910 -14.3023 -14.3023 -13.8652 -13.8652 -13.7580 -13.7580 -9.4674 -9.4674 -9.4526 -9.4526 -7.2606 -7.2606 -7.1993 -7.1993 2.1649 2.1649 2.9476 2.9476 3.2973 3.2973 3.4451 3.4451 3.6098 3.6098 4.0722 4.0722 4.4291 4.4291 4.5869 4.5869 4.5936 4.5936 4.6926 4.6926 4.9399 4.9399 5.0625 5.0625 10.4595 10.4595 11.7249 11.7249 11.9339 11.9339 12.4201 12.4201 12.9871 12.9871 k = 0.4898-1.1674-0.6922 ( 4212 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6201 -15.6201 -15.5677 -15.5677 -14.3911 -14.3911 -14.3037 -14.3037 -13.8650 -13.8650 -13.7584 -13.7584 -9.4637 -9.4637 -9.4532 -9.4532 -7.2592 -7.2592 -7.1986 -7.1986 2.1614 2.1614 2.9430 2.9430 3.3006 3.3006 3.4482 3.4482 3.6128 3.6128 4.0815 4.0815 4.4259 4.4259 4.5802 4.5802 4.6135 4.6135 4.6756 4.6756 4.9378 4.9378 5.0596 5.0596 10.4548 10.4548 11.7262 11.7262 11.9361 11.9361 12.4191 12.4191 12.9902 12.9902 k = 0.5000-1.1918-0.7067 ( 4218 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6202 -15.6202 -15.5684 -15.5684 -14.3912 -14.3912 -14.3042 -14.3042 -13.8650 -13.8650 -13.7586 -13.7586 -9.4623 -9.4623 -9.4536 -9.4536 -7.2587 -7.2587 -7.1984 -7.1984 2.1602 2.1602 2.9414 2.9414 3.3017 3.3017 3.4492 3.4492 3.6139 3.6139 4.0847 4.0847 4.4248 4.4248 4.5778 4.5778 4.6235 4.6235 4.6667 4.6667 4.9370 4.9370 5.0586 5.0586 10.4532 10.4532 11.7266 11.7266 11.9369 11.9369 12.4187 12.4187 12.9913 12.9913 k = 0.5000-1.1918-0.7067 ( 4218 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6202 -15.6202 -15.5684 -15.5684 -14.3912 -14.3912 -14.3042 -14.3042 -13.8650 -13.8650 -13.7586 -13.7586 -9.4623 -9.4623 -9.4536 -9.4536 -7.2587 -7.2587 -7.1984 -7.1984 2.1602 2.1602 2.9414 2.9414 3.3017 3.3017 3.4492 3.4492 3.6139 3.6139 4.0847 4.0847 4.4248 4.4248 4.5778 4.5778 4.6235 4.6235 4.6667 4.6667 4.9370 4.9370 5.0586 5.0586 10.4532 10.4532 11.7266 11.7266 11.9369 11.9369 12.4187 12.4187 12.9913 12.9913 k = 0.5000-1.1766-0.7322 ( 4220 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6213 -15.6213 -15.5672 -15.5672 -14.3933 -14.3933 -14.3024 -14.3024 -13.8652 -13.8652 -13.7589 -13.7589 -9.4647 -9.4647 -9.4503 -9.4503 -7.2587 -7.2587 -7.1984 -7.1984 2.1613 2.1613 2.9420 2.9420 3.3020 3.3020 3.4478 3.4478 3.6137 3.6137 4.0850 4.0850 4.4250 4.4250 4.5750 4.5750 4.6235 4.6235 4.6665 4.6665 4.9373 4.9373 5.0594 5.0594 10.4493 10.4493 11.7259 11.7259 11.9411 11.9411 12.4196 12.4196 12.9915 12.9915 k = 0.5000-1.1615-0.7577 ( 4222 PWs) bands (ev): -34.1908 -34.1908 -34.1740 -34.1740 -15.6241 -15.6241 -15.5638 -15.5638 -14.3992 -14.3992 -14.2975 -14.2975 -13.8661 -13.8661 -13.7598 -13.7598 -9.4682 -9.4682 -9.4438 -9.4438 -7.2587 -7.2587 -7.1986 -7.1986 2.1647 2.1647 2.9437 2.9437 3.3028 3.3028 3.4436 3.4436 3.6134 3.6134 4.0859 4.0859 4.4256 4.4256 4.5664 4.5664 4.6237 4.6237 4.6661 4.6661 4.9381 4.9381 5.0616 5.0616 10.4379 10.4379 11.7238 11.7238 11.9537 11.9537 12.4222 12.4222 12.9922 12.9922 k = 0.5000-1.1463-0.7833 ( 4224 PWs) bands (ev): -34.1907 -34.1907 -34.1740 -34.1740 -15.6282 -15.6282 -15.5588 -15.5588 -14.4080 -14.4080 -14.2904 -14.2904 -13.8676 -13.8676 -13.7613 -13.7613 -9.4712 -9.4712 -9.4360 -9.4360 -7.2586 -7.2586 -7.1990 -7.1990 2.1703 2.1703 2.9465 2.9465 3.3040 3.3040 3.4367 3.4367 3.6130 3.6130 4.0874 4.0874 4.4265 4.4265 4.5522 4.5522 4.6245 4.6245 4.6652 4.6652 4.9394 4.9394 5.0650 5.0650 10.4193 10.4193 11.7202 11.7202 11.9742 11.9742 12.4266 12.4266 12.9933 12.9933 k = 0.5000-1.1312-0.8088 ( 4222 PWs) bands (ev): -34.1906 -34.1906 -34.1740 -34.1740 -15.6330 -15.6330 -15.5527 -15.5527 -14.4188 -14.4188 -14.2820 -14.2820 -13.8696 -13.8696 -13.7633 -13.7633 -9.4734 -9.4734 -9.4272 -9.4272 -7.2585 -7.2585 -7.1994 -7.1994 2.1780 2.1780 2.9505 2.9505 3.3057 3.3057 3.4271 3.4271 3.6125 3.6125 4.0896 4.0896 4.4275 4.4275 4.5329 4.5329 4.6259 4.6259 4.6640 4.6640 4.9413 4.9413 5.0691 5.0691 10.3944 10.3944 11.7151 11.7151 12.0019 12.0019 12.4329 12.4329 12.9950 12.9950 k = 0.5000-1.1160-0.8344 ( 4220 PWs) bands (ev): -34.1904 -34.1904 -34.1740 -34.1740 -15.6383 -15.6383 -15.5458 -15.5458 -14.4310 -14.4310 -14.2728 -14.2728 -13.8721 -13.8721 -13.7659 -13.7659 -9.4746 -9.4746 -9.4175 -9.4175 -7.2584 -7.2584 -7.1999 -7.1999 2.1879 2.1879 2.9555 2.9555 3.3078 3.3078 3.4148 3.4148 3.6123 3.6123 4.0926 4.0926 4.4281 4.4281 4.5095 4.5095 4.6278 4.6278 4.6622 4.6622 4.9436 4.9436 5.0735 5.0735 10.3640 10.3640 11.7085 11.7085 12.0358 12.0358 12.4409 12.4409 12.9973 12.9973 k = 0.5000-1.1009-0.8599 ( 4222 PWs) bands (ev): -34.1901 -34.1901 -34.1740 -34.1740 -15.6437 -15.6437 -15.5384 -15.5384 -14.4441 -14.4441 -14.2632 -14.2632 -13.8753 -13.8753 -13.7690 -13.7690 -9.4749 -9.4749 -9.4072 -9.4072 -7.2582 -7.2582 -7.2006 -7.2006 2.2000 2.2000 2.9616 2.9616 3.3100 3.3100 3.4000 3.4000 3.6124 3.6124 4.0963 4.0963 4.4269 4.4269 4.4842 4.4842 4.6301 4.6301 4.6601 4.6601 4.9465 4.9465 5.0775 5.0775 10.3291 10.3291 11.7003 11.7003 12.0751 12.0751 12.4508 12.4508 13.0002 13.0002 k = 0.5000-1.0857-0.8855 ( 4226 PWs) bands (ev): -34.1898 -34.1898 -34.1740 -34.1740 -15.6492 -15.6492 -15.5307 -15.5307 -14.4579 -14.4579 -14.2533 -14.2533 -13.8790 -13.8790 -13.7725 -13.7725 -9.4743 -9.4743 -9.3962 -9.3962 -7.2580 -7.2580 -7.2013 -7.2013 2.2141 2.2141 2.9688 2.9688 3.3122 3.3122 3.3830 3.3830 3.6132 3.6132 4.1010 4.1010 4.4185 4.4185 4.4628 4.4628 4.6323 4.6323 4.6575 4.6575 4.9499 4.9499 5.0809 5.0809 10.2906 10.2906 11.6904 11.6904 12.1188 12.1188 12.4626 12.4626 13.0036 13.0036 k = 0.5000-1.0706-0.9110 ( 4226 PWs) bands (ev): -34.1895 -34.1895 -34.1740 -34.1740 -15.6547 -15.6547 -15.5227 -15.5227 -14.4723 -14.4723 -14.2434 -14.2434 -13.8832 -13.8832 -13.7763 -13.7763 -9.4729 -9.4729 -9.3847 -9.3847 -7.2577 -7.2577 -7.2021 -7.2021 2.2302 2.2302 2.9769 2.9769 3.3140 3.3140 3.3642 3.3642 3.6148 3.6148 4.1067 4.1067 4.3947 4.3947 4.4540 4.4540 4.6342 4.6342 4.6547 4.6547 4.9537 4.9537 5.0833 5.0833 10.2494 10.2494 11.6790 11.6790 12.1660 12.1660 12.4763 12.4763 13.0074 13.0074 k = 0.5000-1.0554-0.9365 ( 4228 PWs) bands (ev): -34.1891 -34.1891 -34.1740 -34.1740 -15.6601 -15.6601 -15.5145 -15.5145 -14.4871 -14.4871 -14.2335 -14.2335 -13.8879 -13.8879 -13.7805 -13.7805 -9.4707 -9.4707 -9.3728 -9.3728 -7.2574 -7.2574 -7.2030 -7.2030 2.2482 2.2482 2.9858 2.9858 3.3139 3.3139 3.3452 3.3452 3.6175 3.6175 4.1134 4.1134 4.3604 4.3604 4.4533 4.4533 4.6348 4.6348 4.6525 4.6525 4.9579 4.9579 5.0844 5.0844 10.2063 10.2063 11.6660 11.6660 12.2159 12.2159 12.4920 12.4920 13.0110 13.0110 k = 0.5000-1.0403-0.9621 ( 4226 PWs) bands (ev): -34.1887 -34.1887 -34.1740 -34.1740 -15.6654 -15.6654 -15.5062 -15.5062 -14.5022 -14.5022 -14.2236 -14.2236 -13.8932 -13.8932 -13.7848 -13.7848 -9.4679 -9.4679 -9.3605 -9.3605 -7.2570 -7.2570 -7.2040 -7.2040 2.2681 2.2681 2.9954 2.9954 3.3060 3.3060 3.3323 3.3323 3.6214 3.6214 4.1210 4.1210 4.3215 4.3215 4.4549 4.4549 4.6331 4.6331 4.6517 4.6517 4.9626 4.9626 5.0841 5.0841 10.1620 10.1620 11.6515 11.6515 12.2676 12.2676 12.5096 12.5096 13.0130 13.0130 k = 0.5000-1.0252-0.9876 ( 4228 PWs) bands (ev): -34.1882 -34.1882 -34.1740 -34.1740 -15.6705 -15.6705 -15.4980 -15.4980 -14.5175 -14.5175 -14.2137 -14.2137 -13.8990 -13.8990 -13.7893 -13.7893 -9.4644 -9.4644 -9.3480 -9.3480 -7.2565 -7.2565 -7.2049 -7.2049 2.2897 2.2897 3.0053 3.0053 3.2866 3.2866 3.3294 3.3294 3.6269 3.6269 4.1295 4.1295 4.2802 4.2802 4.4572 4.4572 4.6289 4.6289 4.6524 4.6524 4.9676 4.9676 5.0822 5.0822 10.1173 10.1173 11.6358 11.6358 12.3205 12.3205 12.5292 12.5292 13.0112 13.0112 k = 0.5000-1.0100-1.0132 ( 4226 PWs) bands (ev): -34.1878 -34.1878 -34.1740 -34.1740 -15.6754 -15.6754 -15.4897 -15.4897 -14.5328 -14.5328 -14.2039 -14.2039 -13.9053 -13.9053 -13.7939 -13.7939 -9.4605 -9.4605 -9.3355 -9.3355 -7.2559 -7.2559 -7.2059 -7.2059 2.3130 2.3130 3.0152 3.0152 3.2631 3.2631 3.3299 3.3299 3.6340 3.6340 4.1386 4.1386 4.2377 4.2377 4.4591 4.4591 4.6234 4.6234 4.6538 4.6538 4.9730 4.9730 5.0786 5.0786 10.0727 10.0727 11.6189 11.6189 12.3740 12.3740 12.5509 12.5509 13.0042 13.0042 k = 0.5000-0.9949-1.0387 ( 4222 PWs) bands (ev): -34.1872 -34.1872 -34.1741 -34.1741 -15.6802 -15.6802 -15.4815 -15.4815 -14.5481 -14.5481 -14.1942 -14.1942 -13.9120 -13.9120 -13.7984 -13.7984 -9.4561 -9.4561 -9.3230 -9.3230 -7.2552 -7.2552 -7.2069 -7.2069 2.3377 2.3377 3.0243 3.0243 3.2393 3.2393 3.3309 3.3309 3.6428 3.6428 4.1469 4.1469 4.1957 4.1957 4.4600 4.4600 4.6173 4.6173 4.6551 4.6551 4.9788 4.9788 5.0735 5.0735 10.0287 10.0287 11.6010 11.6010 12.4275 12.4275 12.5746 12.5746 12.9930 12.9930 k = 0.5000-0.9797-1.0643 ( 4228 PWs) bands (ev): -34.1867 -34.1867 -34.1741 -34.1741 -15.6847 -15.6847 -15.4735 -15.4735 -14.5633 -14.5633 -14.1845 -14.1845 -13.9193 -13.9193 -13.8028 -13.8028 -9.4513 -9.4513 -9.3106 -9.3106 -7.2545 -7.2545 -7.2078 -7.2078 2.3638 2.3638 3.0311 3.0311 3.2175 3.2175 3.3318 3.3318 3.6534 3.6534 4.1380 4.1380 4.1712 4.1712 4.4591 4.4591 4.6115 4.6115 4.6561 4.6561 4.9848 4.9848 5.0667 5.0667 9.9857 9.9857 11.5825 11.5825 12.4804 12.4804 12.6003 12.6003 12.9800 12.9800 k = 0.5000-0.9646-1.0898 ( 4224 PWs) bands (ev): -34.1861 -34.1861 -34.1742 -34.1742 -15.6891 -15.6891 -15.4657 -15.4657 -14.5781 -14.5781 -14.1748 -14.1748 -13.9269 -13.9269 -13.8071 -13.8071 -9.4463 -9.4463 -9.2985 -9.2985 -7.2536 -7.2536 -7.2087 -7.2087 2.3911 2.3911 3.0334 3.0334 3.2002 3.2002 3.3325 3.3325 3.6658 3.6658 4.0981 4.0981 4.1782 4.1782 4.4555 4.4555 4.6070 4.6070 4.6564 4.6564 4.9909 4.9909 5.0584 5.0584 9.9442 9.9442 11.5636 11.5636 12.5323 12.5323 12.6282 12.6282 12.9662 12.9662 k = 0.5000-0.9494-1.1154 ( 4220 PWs) bands (ev): -34.1856 -34.1856 -34.1743 -34.1743 -15.6932 -15.6932 -15.4581 -15.4581 -14.5926 -14.5926 -14.1653 -14.1653 -13.9350 -13.9350 -13.8112 -13.8112 -9.4412 -9.4412 -9.2867 -9.2867 -7.2526 -7.2526 -7.2096 -7.2096 2.4195 2.4195 3.0288 3.0288 3.1904 3.1904 3.3329 3.3329 3.6797 3.6797 4.0543 4.0543 4.1900 4.1900 4.4487 4.4487 4.6044 4.6044 4.6561 4.6561 4.9971 4.9971 5.0488 5.0488 9.9044 9.9044 11.5446 11.5446 12.5823 12.5823 12.6585 12.6585 12.9523 12.9523 k = 0.5000-0.9343-1.1409 ( 4226 PWs) bands (ev): -34.1850 -34.1850 -34.1744 -34.1744 -15.6971 -15.6971 -15.4509 -15.4509 -14.6066 -14.6066 -14.1557 -14.1557 -13.9434 -13.9434 -13.8151 -13.8151 -9.4360 -9.4360 -9.2754 -9.2754 -7.2516 -7.2516 -7.2105 -7.2105 2.4487 2.4487 3.0158 3.0158 3.1896 3.1896 3.3331 3.3331 3.6946 3.6946 4.0109 4.0109 4.2025 4.2025 4.4383 4.4383 4.6040 4.6040 4.6551 4.6551 5.0031 5.0031 5.0381 5.0381 9.8668 9.8668 11.5258 11.5258 12.6298 12.6298 12.6914 12.6914 12.9387 12.9387 k = 0.5000-0.9191-1.1664 ( 4226 PWs) bands (ev): -34.1844 -34.1844 -34.1746 -34.1746 -15.7008 -15.7008 -15.4440 -15.4440 -14.6199 -14.6199 -14.1462 -14.1462 -13.9522 -13.9522 -13.8187 -13.8187 -9.4309 -9.4309 -9.2647 -9.2647 -7.2504 -7.2504 -7.2113 -7.2113 2.4785 2.4785 2.9957 2.9957 3.1970 3.1970 3.3332 3.3332 3.7097 3.7097 3.9696 3.9696 4.2150 4.2150 4.4247 4.4247 4.6055 4.6055 4.6537 4.6537 5.0079 5.0079 5.0273 5.0273 9.8315 9.8315 11.5074 11.5074 12.6741 12.6741 12.7272 12.7272 12.9255 12.9255 k = 0.5000-0.9040-1.1920 ( 4222 PWs) bands (ev): -34.1837 -34.1837 -34.1747 -34.1747 -15.7042 -15.7042 -15.4376 -15.4376 -14.6325 -14.6325 -14.1368 -14.1368 -13.9611 -13.9611 -13.8220 -13.8220 -9.4259 -9.4259 -9.2547 -9.2547 -7.2492 -7.2492 -7.2120 -7.2120 2.5087 2.5087 2.9708 2.9708 3.2103 3.2103 3.3333 3.3333 3.7230 3.7230 3.9325 3.9325 4.2263 4.2263 4.4090 4.4090 4.6078 4.6078 4.6525 4.6525 5.0058 5.0058 5.0223 5.0223 9.7988 9.7988 11.4897 11.4897 12.7151 12.7151 12.7654 12.7654 12.9130 12.9130 k = 0.5000-0.8888-1.2175 ( 4228 PWs) bands (ev): -34.1831 -34.1831 -34.1749 -34.1749 -15.7073 -15.7073 -15.4317 -15.4317 -14.6442 -14.6442 -14.1275 -14.1275 -13.9703 -13.9703 -13.8250 -13.8250 -9.4211 -9.4211 -9.2455 -9.2455 -7.2479 -7.2479 -7.2127 -7.2127 2.5392 2.5392 2.9433 2.9433 3.2275 3.2275 3.3335 3.3335 3.7308 3.7308 3.9036 3.9036 4.2348 4.2348 4.3932 4.3932 4.6091 4.6091 4.6529 4.6529 4.9942 4.9942 5.0257 5.0257 9.7689 9.7689 11.4731 11.4731 12.7532 12.7532 12.8047 12.8047 12.9016 12.9016 k = 0.5000-0.8737-1.2431 ( 4234 PWs) bands (ev): -34.1825 -34.1825 -34.1751 -34.1751 -15.7102 -15.7102 -15.4264 -15.4264 -14.6549 -14.6549 -14.1182 -14.1182 -13.9796 -13.9796 -13.8276 -13.8276 -9.4166 -9.4166 -9.2370 -9.2370 -7.2466 -7.2466 -7.2134 -7.2134 2.5696 2.5696 2.9145 2.9145 3.2475 3.2475 3.3339 3.3339 3.7273 3.7273 3.8890 3.8890 4.2379 4.2379 4.3803 4.3803 4.6073 4.6073 4.6565 4.6565 4.9800 4.9800 5.0308 5.0308 9.7420 9.7420 11.4577 11.4577 12.7892 12.7892 12.8428 12.8428 12.8927 12.8927 k = 0.5000-0.8585-1.2686 ( 4238 PWs) bands (ev): -34.1818 -34.1818 -34.1754 -34.1754 -15.7127 -15.7127 -15.4217 -15.4217 -14.6645 -14.6645 -14.1090 -14.1090 -13.9889 -13.9889 -13.8300 -13.8300 -9.4125 -9.4125 -9.2295 -9.2295 -7.2452 -7.2452 -7.2140 -7.2140 2.5997 2.5997 2.8854 2.8854 3.2694 3.2694 3.3347 3.3347 3.7093 3.7093 3.8919 3.8919 4.2322 4.2322 4.3739 4.3739 4.6015 4.6015 4.6636 4.6636 4.9649 4.9649 5.0359 5.0359 9.7181 9.7181 11.4437 11.4437 12.8218 12.8218 12.8701 12.8701 12.8964 12.8964 k = 0.5000-0.8434-1.2942 ( 4234 PWs) bands (ev): -34.1812 -34.1812 -34.1757 -34.1757 -15.7150 -15.7150 -15.4176 -15.4176 -14.6729 -14.6729 -14.0999 -14.0999 -13.9982 -13.9982 -13.8320 -13.8320 -9.4088 -9.4088 -9.2230 -9.2230 -7.2439 -7.2439 -7.2145 -7.2145 2.6293 2.6293 2.8566 2.8566 3.2926 3.2926 3.3360 3.3360 3.6812 3.6812 3.9083 3.9083 4.2163 4.2163 4.3758 4.3758 4.5920 4.5920 4.6736 4.6736 4.9496 4.9496 5.0406 5.0406 9.6976 9.6976 11.4314 11.4314 12.8416 12.8416 12.8826 12.8826 12.9257 12.9257 k = 0.5000-0.8283-1.3197 ( 4244 PWs) bands (ev): -34.1806 -34.1806 -34.1760 -34.1760 -15.7169 -15.7169 -15.4143 -15.4143 -14.6800 -14.6800 -14.0909 -14.0909 -14.0075 -14.0075 -13.8336 -13.8336 -9.4056 -9.4056 -9.2174 -9.2174 -7.2426 -7.2426 -7.2150 -7.2150 2.6581 2.6581 2.8285 2.8285 3.3159 3.3159 3.3386 3.3386 3.6482 3.6482 3.9329 3.9329 4.1919 4.1919 4.3845 4.3845 4.5795 4.5795 4.6853 4.6853 4.9344 4.9344 5.0449 5.0449 9.6804 9.6804 11.4209 11.4209 12.8408 12.8408 12.9095 12.9095 12.9586 12.9586 k = 0.5000-0.8131-1.3453 ( 4240 PWs) bands (ev): -34.1800 -34.1800 -34.1764 -34.1764 -15.7184 -15.7184 -15.4116 -15.4116 -14.6857 -14.6857 -14.0822 -14.0822 -14.0165 -14.0165 -13.8349 -13.8349 -9.4030 -9.4030 -9.2130 -9.2130 -7.2413 -7.2413 -7.2155 -7.2155 2.6858 2.6858 2.8016 2.8016 3.3324 3.3324 3.3492 3.3492 3.6139 3.6139 3.9625 3.9625 4.1614 4.1614 4.3977 4.3977 4.5645 4.5645 4.6983 4.6983 4.9194 4.9194 5.0485 5.0485 9.6666 9.6666 11.4124 11.4124 12.8331 12.8331 12.9419 12.9419 12.9895 12.9895 k = 0.5000-0.7980-1.3708 ( 4240 PWs) bands (ev): -34.1794 -34.1794 -34.1768 -34.1768 -15.7196 -15.7196 -15.4097 -15.4097 -14.6900 -14.6900 -14.0738 -14.0738 -14.0251 -14.0251 -13.8359 -13.8359 -9.4010 -9.4010 -9.2096 -9.2096 -7.2402 -7.2402 -7.2159 -7.2159 2.7122 2.7122 2.7760 2.7760 3.3368 3.3368 3.3725 3.3725 3.5802 3.5802 3.9954 3.9954 4.1272 4.1272 4.4135 4.4135 4.5471 4.5471 4.7120 4.7120 4.9051 4.9051 5.0515 5.0515 9.6564 9.6564 11.4059 11.4059 12.8239 12.8239 12.9742 12.9742 13.0179 13.0179 k = 0.5000-0.7828-1.3963 ( 4236 PWs) bands (ev): -34.1788 -34.1788 -34.1772 -34.1772 -15.7204 -15.7204 -15.4085 -15.4085 -14.6929 -14.6929 -14.0663 -14.0663 -14.0328 -14.0328 -13.8366 -13.8366 -9.3996 -9.3996 -9.2074 -9.2074 -7.2393 -7.2393 -7.2164 -7.2164 2.7363 2.7363 2.7528 2.7528 3.3387 3.3387 3.3985 3.3985 3.5485 3.5485 4.0304 4.0304 4.0907 4.0907 4.4304 4.4304 4.5279 4.5279 4.7260 4.7260 4.8915 4.8915 5.0538 5.0538 9.6498 9.6498 11.4015 11.4015 12.8143 12.8144 13.0032 13.0032 13.0445 13.0445 k = 0.5000-0.7677-1.4219 ( 4226 PWs) bands (ev): -34.1782 -34.1782 -34.1777 -34.1777 -15.7208 -15.7208 -15.4079 -15.4079 -14.6943 -14.6943 -14.0611 -14.0611 -14.0381 -14.0381 -13.8369 -13.8369 -9.3990 -9.3990 -9.2063 -9.2063 -7.2386 -7.2386 -7.2168 -7.2168 2.7287 2.7287 2.7615 2.7615 3.3391 3.3391 3.4248 3.4248 3.5199 3.5199 4.0485 4.0485 4.0714 4.0714 4.4473 4.4473 4.5078 4.5078 4.7400 4.7400 4.8789 4.8789 5.0554 5.0554 9.6468 9.6468 11.3994 11.3994 12.8048 12.8048 13.0256 13.0256 13.0710 13.0710 k = 0.5000-0.7525-1.4474 ( 4222 PWs) bands (ev): -34.1783 -34.1783 -34.1777 -34.1777 -15.7208 -15.7208 -15.4079 -15.4079 -14.6942 -14.6942 -14.0615 -14.0615 -14.0377 -14.0377 -13.8369 -13.8369 -9.3990 -9.3990 -9.2064 -9.2064 -7.2382 -7.2382 -7.2172 -7.2172 2.7086 2.7086 2.7827 2.7827 3.3375 3.3375 3.4502 3.4502 3.4964 3.4964 4.0111 4.0111 4.1082 4.1082 4.4590 4.4590 4.4915 4.4915 4.7538 4.7538 4.8674 4.8674 5.0565 5.0565 9.6475 9.6475 11.3995 11.3995 12.7953 12.7953 13.0387 13.0387 13.0923 13.0923 k = 0.5000-0.7374-1.4730 ( 4232 PWs) bands (ev): -34.1789 -34.1789 -34.1771 -34.1771 -15.7203 -15.7203 -15.4085 -15.4085 -14.6927 -14.6927 -14.0667 -14.0667 -14.0323 -14.0323 -13.8365 -13.8365 -9.3998 -9.3998 -9.2076 -9.2076 -7.2382 -7.2382 -7.2175 -7.2175 2.6902 2.6902 2.8023 2.8023 3.3328 3.3328 3.4670 3.4670 3.4866 3.4866 3.9716 3.9716 4.1477 4.1477 4.4489 4.4489 4.4959 4.4959 4.7668 4.7668 4.8572 4.8572 5.0571 5.0571 9.6518 9.6518 11.4018 11.4018 12.7860 12.7860 13.0412 13.0412 13.0815 13.0815 k = 0.8242-0.6721-1.3536 ( 4232 PWs) bands (ev): -34.1789 -34.1789 -34.1771 -34.1771 -15.7203 -15.7203 -15.4085 -15.4085 -14.6927 -14.6927 -14.0667 -14.0667 -14.0323 -14.0323 -13.8365 -13.8365 -9.3998 -9.3998 -9.2076 -9.2076 -7.2382 -7.2382 -7.2175 -7.2175 2.6902 2.6902 2.8023 2.8023 3.3328 3.3328 3.4670 3.4670 3.4866 3.4866 3.9716 3.9716 4.1477 4.1477 4.4489 4.4489 4.4959 4.4959 4.7668 4.7668 4.8572 4.8572 5.0571 5.0571 9.6518 9.6518 11.4018 11.4018 12.7860 12.7860 13.0412 13.0412 13.0815 13.0815 k = 0.8182-0.6578-1.3275 ( 4234 PWs) bands (ev): -34.1795 -34.1795 -34.1766 -34.1766 -15.7194 -15.7194 -15.4096 -15.4096 -14.6896 -14.6896 -14.0738 -14.0738 -14.0250 -14.0250 -13.8358 -13.8358 -9.4014 -9.4014 -9.2101 -9.2101 -7.2387 -7.2387 -7.2179 -7.2179 2.6737 2.6737 2.8203 2.8203 3.3238 3.3238 3.4606 3.4606 3.5057 3.5057 3.9318 3.9318 4.1886 4.1886 4.4255 4.4255 4.5125 4.5125 4.7789 4.7789 4.8484 4.8484 5.0574 5.0574 9.6601 9.6601 11.4064 11.4064 12.7766 12.7766 13.0275 13.0275 13.0645 13.0645 k = 0.8122-0.6435-1.3013 ( 4232 PWs) bands (ev): -34.1802 -34.1802 -34.1762 -34.1762 -15.7179 -15.7179 -15.4111 -15.4111 -14.6852 -14.6852 -14.0811 -14.0811 -14.0172 -14.0172 -13.8347 -13.8347 -9.4038 -9.4038 -9.2137 -9.2137 -7.2396 -7.2396 -7.2183 -7.2183 2.6595 2.6595 2.8362 2.8362 3.3107 3.3107 3.4557 3.4557 3.5275 3.5275 3.8940 3.8940 4.2284 4.2284 4.4010 4.4010 4.5309 4.5309 4.7890 4.7890 4.8416 4.8416 5.0578 5.0578 9.6722 9.6722 11.4132 11.4132 12.7674 12.7674 13.0001 13.0001 13.0538 13.0538 k = 0.8062-0.6292-1.2751 ( 4236 PWs) bands (ev): -34.1810 -34.1810 -34.1758 -34.1758 -15.7159 -15.7159 -15.4129 -15.4129 -14.6795 -14.6795 -14.0884 -14.0884 -14.0094 -14.0094 -13.8333 -13.8333 -9.4071 -9.4071 -9.2186 -9.2186 -7.2411 -7.2411 -7.2186 -7.2186 2.6477 2.6477 2.8501 2.8501 3.2951 3.2951 3.4556 3.4556 3.5457 3.5457 3.8600 3.8600 4.2627 4.2627 4.3809 4.3809 4.5494 4.5494 4.7961 4.7961 4.8373 4.8373 5.0585 5.0585 9.6881 9.6881 11.4222 11.4222 12.7583 12.7583 12.9687 12.9687 13.0421 13.0421 k = 0.8002-0.6149-1.2489 ( 4240 PWs) bands (ev): -34.1818 -34.1818 -34.1754 -34.1754 -15.7134 -15.7134 -15.4149 -15.4149 -14.6725 -14.6725 -14.0954 -14.0954 -14.0017 -14.0017 -13.8315 -13.8315 -9.4112 -9.4112 -9.2246 -9.2246 -7.2431 -7.2431 -7.2191 -7.2191 2.6384 2.6384 2.8618 2.8618 3.2785 3.2785 3.4589 3.4589 3.5572 3.5572 3.8327 3.8327 4.2793 4.2793 4.3782 4.3782 4.5674 4.5674 4.7997 4.7997 4.8356 4.8356 5.0601 5.0601 9.7078 9.7078 11.4331 11.4331 12.7492 12.7492 12.9367 12.9367 13.0269 13.0269 k = 0.7942-0.6006-1.2228 ( 4236 PWs) bands (ev): -34.1827 -34.1827 -34.1750 -34.1750 -15.7104 -15.7104 -15.4170 -15.4170 -14.6643 -14.6643 -14.1021 -14.1021 -13.9941 -13.9941 -13.8294 -13.8294 -9.4162 -9.4162 -9.2317 -9.2317 -7.2457 -7.2457 -7.2197 -7.2197 2.6316 2.6316 2.8716 2.8716 3.2623 3.2623 3.4642 3.4642 3.5588 3.5588 3.8154 3.8154 4.2687 4.2687 4.4021 4.4021 4.5846 4.5846 4.8002 4.8002 4.8355 4.8355 5.0630 5.0630 9.7312 9.7312 11.4457 11.4457 12.7401 12.7401 12.9051 12.9051 13.0079 13.0079 k = 0.7882-0.5863-1.1966 ( 4244 PWs) bands (ev): -34.1837 -34.1837 -34.1747 -34.1747 -15.7068 -15.7068 -15.4191 -15.4191 -14.6551 -14.6551 -14.1084 -14.1084 -13.9868 -13.9868 -13.8269 -13.8269 -9.4220 -9.4220 -9.2399 -9.2399 -7.2488 -7.2488 -7.2204 -7.2204 2.6274 2.6274 2.8794 2.8794 3.2473 3.2473 3.4704 3.4704 3.5486 3.5486 3.8100 3.8100 4.2441 4.2441 4.4397 4.4397 4.6009 4.6009 4.7992 4.7992 4.8351 4.8351 5.0676 5.0676 9.7581 9.7581 11.4600 11.4600 12.7304 12.7304 12.8746 12.8746 12.9852 12.9852 k = 0.7822-0.5719-1.1704 ( 4242 PWs) bands (ev): -34.1847 -34.1847 -34.1745 -34.1745 -15.7026 -15.7026 -15.4211 -15.4211 -14.6449 -14.6449 -14.1143 -14.1143 -13.9797 -13.9797 -13.8241 -13.8241 -9.4287 -9.4287 -9.2493 -9.2493 -7.2525 -7.2525 -7.2214 -7.2214 2.6256 2.6256 2.8854 2.8854 3.2341 3.2341 3.4765 3.4765 3.5278 3.5278 3.8157 3.8157 4.2152 4.2152 4.4814 4.4814 4.6160 4.6160 4.7979 4.7979 4.8331 4.8331 5.0742 5.0742 9.7886 9.7886 11.4754 11.4754 12.7197 12.7197 12.8460 12.8460 12.9589 12.9589 k = 0.7762-0.5576-1.1443 ( 4236 PWs) bands (ev): -34.1857 -34.1857 -34.1743 -34.1743 -15.6979 -15.6979 -15.4228 -15.4228 -14.6338 -14.6338 -14.1198 -14.1198 -13.9729 -13.9729 -13.8209 -13.8209 -9.4363 -9.4363 -9.2597 -9.2597 -7.2567 -7.2567 -7.2225 -7.2225 2.6262 2.6262 2.8897 2.8897 3.2229 3.2229 3.4800 3.4800 3.5016 3.5016 3.8293 3.8293 4.1849 4.1849 4.5243 4.5243 4.6298 4.6298 4.7966 4.7966 4.8291 4.8291 5.0830 5.0830 9.8224 9.8224 11.4918 11.4918 12.7068 12.7068 12.8205 12.8205 12.9294 12.9294 k = 0.7702-0.5433-1.1181 ( 4238 PWs) bands (ev): -34.1869 -34.1869 -34.1741 -34.1741 -15.6926 -15.6926 -15.4243 -15.4243 -14.6219 -14.6219 -14.1247 -14.1247 -13.9663 -13.9663 -13.8175 -13.8175 -9.4447 -9.4447 -9.2711 -9.2711 -7.2614 -7.2614 -7.2239 -7.2239 2.6291 2.6291 2.8925 2.8925 3.2139 3.2139 3.4612 3.4612 3.4925 3.4925 3.8476 3.8476 4.1547 4.1547 4.5671 4.5671 4.6421 4.6421 4.7951 4.7951 4.8236 4.8236 5.0938 5.0938 9.8594 9.8594 11.5088 11.5088 12.6905 12.6905 12.7995 12.7995 12.8971 12.8971 k = 0.7642-0.5290-1.0919 ( 4230 PWs) bands (ev): -34.1880 -34.1880 -34.1740 -34.1740 -15.6867 -15.6867 -15.4253 -15.4253 -14.6093 -14.6093 -14.1292 -14.1292 -13.9600 -13.9600 -13.8137 -13.8137 -9.4540 -9.4540 -9.2836 -9.2836 -7.2666 -7.2666 -7.2256 -7.2256 2.6341 2.6341 2.8939 2.8939 3.2071 3.2071 3.4273 3.4273 3.4954 3.4954 3.8683 3.8683 4.1253 4.1253 4.6090 4.6090 4.6528 4.6528 4.7920 4.7920 4.8189 4.8189 5.1065 5.1065 9.8993 9.8993 11.5259 11.5259 12.6699 12.6699 12.7839 12.7839 12.8625 12.8625 k = 0.7582-0.5147-1.0657 ( 4238 PWs) bands (ev): -34.1893 -34.1893 -34.1739 -34.1739 -15.6804 -15.6804 -15.4260 -15.4260 -14.5961 -14.5961 -14.1331 -14.1331 -13.9540 -13.9540 -13.8097 -13.8097 -9.4642 -9.4642 -9.2970 -9.2970 -7.2724 -7.2724 -7.2275 -7.2275 2.6409 2.6409 2.8942 2.8942 3.2025 3.2025 3.3921 3.3921 3.4978 3.4978 3.8898 3.8898 4.0972 4.0972 4.6494 4.6494 4.6617 4.6617 4.7849 4.7849 4.8178 4.8178 5.1207 5.1207 9.9418 9.9418 11.5428 11.5428 12.6451 12.6451 12.7729 12.7729 12.8266 12.8266 k = 0.7522-0.5004-1.0396 ( 4240 PWs) bands (ev): -34.1905 -34.1905 -34.1739 -34.1739 -15.6735 -15.6735 -15.4260 -15.4260 -14.5823 -14.5823 -14.1365 -14.1365 -13.9482 -13.9482 -13.8054 -13.8054 -9.4753 -9.4753 -9.3114 -9.3114 -7.2786 -7.2786 -7.2297 -7.2297 2.6493 2.6493 2.8935 2.8935 3.1998 3.1998 3.3576 3.3576 3.4987 3.4987 3.9108 3.9108 4.0710 4.0710 4.6685 4.6685 4.6874 4.6874 4.7741 4.7741 4.8217 4.8217 5.1362 5.1362 9.9866 9.9866 11.5588 11.5588 12.6173 12.6173 12.7617 12.7617 12.7939 12.7939 k = 0.7462-0.4861-1.0134 ( 4236 PWs) bands (ev): -34.1919 -34.1919 -34.1740 -34.1740 -15.6661 -15.6661 -15.4255 -15.4255 -14.5681 -14.5681 -14.1393 -14.1393 -13.9427 -13.9427 -13.8009 -13.8009 -9.4873 -9.4873 -9.3268 -9.3268 -7.2852 -7.2852 -7.2322 -7.2322 2.6586 2.6586 2.8920 2.8920 3.1989 3.1989 3.3251 3.3251 3.4975 3.4975 3.9305 3.9305 4.0473 4.0473 4.6731 4.6731 4.7214 4.7214 4.7617 4.7617 4.8303 4.8303 5.1527 5.1527 10.0335 10.0335 11.5737 11.5737 12.5875 12.5875 12.7351 12.7351 12.7790 12.7790 k = 0.7402-0.4718-0.9872 ( 4234 PWs) bands (ev): -34.1933 -34.1933 -34.1741 -34.1741 -15.6583 -15.6583 -15.4243 -15.4243 -14.5535 -14.5535 -14.1415 -14.1415 -13.9373 -13.9373 -13.7963 -13.7963 -9.5002 -9.5002 -9.3431 -9.3431 -7.2923 -7.2923 -7.2349 -7.2349 2.6685 2.6685 2.8900 2.8900 3.1995 3.1995 3.2956 3.2956 3.4941 3.4941 3.9478 3.9478 4.0269 4.0269 4.6751 4.6751 4.7438 4.7438 4.7555 4.7555 4.8444 4.8444 5.1699 5.1699 10.0819 10.0819 11.5869 11.5869 12.5565 12.5565 12.6963 12.6963 12.7780 12.7780 k = 0.7341-0.4575-0.9610 ( 4232 PWs) bands (ev): -34.1947 -34.1947 -34.1742 -34.1742 -15.6500 -15.6500 -15.4224 -15.4224 -14.5386 -14.5386 -14.1431 -14.1431 -13.9322 -13.9322 -13.7915 -13.7915 -9.5140 -9.5140 -9.3603 -9.3603 -7.2998 -7.2998 -7.2377 -7.2377 2.6781 2.6781 2.8876 2.8876 3.2013 3.2013 3.2700 3.2700 3.4883 3.4883 3.9611 3.9611 4.0110 4.0110 4.6737 4.6737 4.7353 4.7353 4.7754 4.7754 4.8646 4.8646 5.1877 5.1877 10.1316 10.1316 11.5979 11.5979 12.5251 12.5251 12.6546 12.6546 12.7815 12.7815 k = 0.7281-0.4432-0.9349 ( 4228 PWs) bands (ev): -34.1962 -34.1962 -34.1744 -34.1744 -15.6414 -15.6414 -15.4198 -15.4198 -14.5234 -14.5234 -14.1439 -14.1439 -13.9272 -13.9272 -13.7866 -13.7866 -9.5287 -9.5287 -9.3784 -9.3784 -7.3077 -7.3077 -7.2408 -7.2408 2.6866 2.6866 2.8850 2.8850 3.2040 3.2040 3.2495 3.2495 3.4800 3.4800 3.9675 3.9675 4.0023 4.0023 4.6681 4.6681 4.7270 4.7270 4.7927 4.7927 4.8898 4.8898 5.2058 5.2058 10.1819 10.1819 11.6065 11.6065 12.4934 12.4934 12.6117 12.6117 12.7875 12.7875 k = 0.7221-0.4288-0.9087 ( 4224 PWs) bands (ev): -34.1977 -34.1977 -34.1746 -34.1746 -15.6325 -15.6325 -15.4165 -15.4165 -14.5080 -14.5080 -14.1440 -14.1440 -13.9223 -13.9223 -13.7816 -13.7816 -9.5443 -9.5443 -9.3974 -9.3974 -7.3158 -7.3158 -7.2439 -7.2439 2.6931 2.6931 2.8823 2.8823 3.2072 3.2072 3.2349 3.2349 3.4693 3.4693 3.9659 3.9659 4.0016 4.0016 4.6585 4.6585 4.7220 4.7220 4.8068 4.8068 4.9178 4.9178 5.2242 5.2242 10.2324 10.2324 11.6123 11.6123 12.4620 12.4620 12.5683 12.5683 12.7950 12.7950 k = 0.7161-0.4145-0.8825 ( 4224 PWs) bands (ev): -34.1992 -34.1992 -34.1749 -34.1749 -15.6233 -15.6233 -15.4123 -15.4123 -14.4925 -14.4925 -14.1433 -14.1433 -13.9175 -13.9175 -13.7767 -13.7767 -9.5608 -9.5608 -9.4173 -9.4173 -7.3243 -7.3243 -7.2472 -7.2472 2.6968 2.6968 2.8798 2.8798 3.2107 3.2107 3.2272 3.2272 3.4562 3.4562 3.9617 3.9617 4.0031 4.0031 4.6458 4.6458 4.7204 4.7204 4.8195 4.8195 4.9464 4.9464 5.2425 5.2425 10.2825 10.2825 11.6150 11.6150 12.4309 12.4309 12.5245 12.5245 12.8033 12.8033 k = 0.7101-0.4002-0.8564 ( 4224 PWs) bands (ev): -34.2008 -34.2008 -34.1753 -34.1753 -15.6138 -15.6138 -15.4074 -15.4074 -14.4770 -14.4770 -14.1418 -14.1418 -13.9128 -13.9128 -13.7717 -13.7717 -9.5782 -9.5782 -9.4380 -9.4380 -7.3329 -7.3329 -7.2506 -7.2506 2.6970 2.6970 2.8774 2.8774 3.2144 3.2144 3.2268 3.2268 3.4409 3.4409 3.9592 3.9592 4.0023 4.0023 4.6312 4.6312 4.7215 4.7215 4.8318 4.8318 4.9745 4.9745 5.2609 5.2609 10.3317 10.3317 11.6147 11.6147 12.4003 12.4003 12.4806 12.4806 12.8116 12.8116 k = 0.7041-0.3859-0.8302 ( 4224 PWs) bands (ev): -34.2025 -34.2025 -34.1756 -34.1756 -15.6042 -15.6042 -15.4017 -15.4017 -14.4615 -14.4615 -14.1394 -14.1394 -13.9080 -13.9080 -13.7668 -13.7668 -9.5966 -9.5966 -9.4596 -9.4596 -7.3418 -7.3418 -7.2539 -7.2539 2.6934 2.6934 2.8753 2.8753 3.2175 3.2175 3.2346 3.2346 3.4236 3.4236 3.9594 3.9594 3.9981 3.9981 4.6152 4.6152 4.7253 4.7253 4.8443 4.8443 5.0013 5.0013 5.2790 5.2790 10.3795 10.3795 11.6112 11.6112 12.3704 12.3704 12.4366 12.4366 12.8190 12.8190 k = 0.6981-0.3716-0.8040 ( 4220 PWs) bands (ev): -34.2041 -34.2041 -34.1761 -34.1761 -15.5946 -15.5946 -15.3952 -15.3952 -14.4461 -14.4461 -14.1361 -14.1361 -13.9033 -13.9033 -13.7620 -13.7620 -9.6158 -9.6158 -9.4820 -9.4820 -7.3507 -7.3507 -7.2573 -7.2573 2.6863 2.6863 2.8736 2.8736 3.2193 3.2193 3.2504 3.2504 3.4048 3.4048 3.9612 3.9612 3.9916 3.9916 4.5981 4.5981 4.7317 4.7317 4.8572 4.8572 5.0266 5.0266 5.2968 5.2968 10.4253 10.4253 11.6047 11.6047 12.3411 12.3411 12.3926 12.3926 12.8246 12.8246 k = 0.6921-0.3573-0.7778 ( 4216 PWs) bands (ev): -34.2058 -34.2058 -34.1765 -34.1765 -15.5848 -15.5848 -15.3879 -15.3879 -14.4309 -14.4309 -14.1317 -14.1317 -13.8985 -13.8985 -13.7572 -13.7572 -9.6359 -9.6359 -9.5053 -9.5053 -7.3597 -7.3597 -7.2605 -7.2605 2.6761 2.6761 2.8723 2.8723 3.2201 3.2201 3.2733 3.2733 3.3847 3.3847 3.9582 3.9582 3.9891 3.9891 4.5797 4.5797 4.7409 4.7409 4.8708 4.8708 5.0499 5.0499 5.3143 5.3143 10.4688 10.4688 11.5953 11.5953 12.3120 12.3120 12.3491 12.3491 12.8277 12.8277 k = 0.6861-0.3430-0.7517 ( 4218 PWs) bands (ev): -34.2075 -34.2075 -34.1770 -34.1770 -15.5752 -15.5752 -15.3799 -15.3799 -14.4158 -14.4158 -14.1264 -14.1264 -13.8936 -13.8936 -13.7526 -13.7526 -9.6569 -9.6569 -9.5293 -9.5293 -7.3687 -7.3687 -7.2637 -7.2637 2.6637 2.6637 2.8716 2.8716 3.2197 3.2197 3.3023 3.3023 3.3638 3.3638 3.9441 3.9441 3.9975 3.9975 4.5600 4.5600 4.7530 4.7530 4.8850 4.8850 5.0710 5.0710 5.3313 5.3313 10.5094 10.5094 11.5833 11.5833 12.2813 12.2813 12.3079 12.3079 12.8277 12.8277 k = 0.6801-0.3287-0.7255 ( 4226 PWs) bands (ev): -34.2092 -34.2092 -34.1776 -34.1776 -15.5656 -15.5656 -15.3712 -15.3712 -14.4011 -14.4011 -14.1199 -14.1199 -13.8887 -13.8887 -13.7481 -13.7481 -9.6788 -9.6788 -9.5540 -9.5540 -7.3777 -7.3777 -7.2668 -7.2668 2.6497 2.6497 2.8713 2.8713 3.2180 3.2180 3.3311 3.3311 3.3475 3.3475 3.9227 3.9227 4.0132 4.0132 4.5390 4.5390 4.7677 4.7677 4.8998 4.8998 5.0900 5.0900 5.3478 5.3478 10.5469 10.5469 11.5689 11.5689 12.2440 12.2440 12.2740 12.2740 12.8241 12.8241 k = 0.6741-0.3144-0.6993 ( 4228 PWs) bands (ev): -34.2109 -34.2109 -34.1781 -34.1781 -15.5561 -15.5561 -15.3619 -15.3619 -14.3867 -14.3867 -14.1124 -14.1124 -13.8836 -13.8836 -13.7438 -13.7438 -9.7015 -9.7015 -9.5795 -9.5795 -7.3866 -7.3866 -7.2696 -7.2696 2.6349 2.6349 2.8717 2.8717 3.2149 3.2149 3.3165 3.3165 3.3785 3.3785 3.8969 3.8969 4.0339 4.0339 4.5166 4.5166 4.7848 4.7848 4.9153 4.9153 5.1067 5.1067 5.3637 5.3637 10.5811 10.5811 11.5525 11.5525 12.2002 12.2002 12.2472 12.2472 12.8167 12.8167 k = 0.6681-0.3001-0.6732 ( 4218 PWs) bands (ev): -34.2127 -34.2127 -34.1787 -34.1787 -15.5468 -15.5468 -15.3519 -15.3519 -14.3726 -14.3726 -14.1037 -14.1037 -13.8783 -13.8783 -13.7397 -13.7397 -9.7250 -9.7250 -9.6057 -9.6057 -7.3953 -7.3953 -7.2723 -7.2723 2.6200 2.6200 2.8727 2.8727 3.2103 3.2103 3.2939 3.2939 3.4206 3.4206 3.8680 3.8680 4.0586 4.0586 4.4931 4.4931 4.8038 4.8038 4.9313 4.9313 5.1210 5.1210 5.3790 5.3790 10.6118 10.6118 11.5345 11.5345 12.1533 12.1533 12.2242 12.2242 12.8055 12.8055 k = 0.6621-0.2857-0.6470 ( 4222 PWs) bands (ev): -34.2144 -34.2144 -34.1794 -34.1794 -15.5377 -15.5377 -15.3415 -15.3415 -14.3590 -14.3590 -14.0939 -14.0939 -13.8728 -13.8728 -13.7358 -13.7358 -9.7492 -9.7492 -9.6326 -9.6326 -7.4039 -7.4039 -7.2748 -7.2748 2.6056 2.6056 2.8743 2.8743 3.2045 3.2045 3.2707 3.2707 3.4657 3.4657 3.8366 3.8366 4.0869 4.0869 4.4687 4.4687 4.8245 4.8245 4.9478 4.9478 5.1329 5.1329 5.3937 5.3937 10.6390 10.6390 11.5150 11.5150 12.1049 12.1049 12.2033 12.2033 12.7906 12.7906 k = 0.6561-0.2714-0.6208 ( 4218 PWs) bands (ev): -34.2161 -34.2161 -34.1800 -34.1800 -15.5288 -15.5288 -15.3306 -15.3306 -14.3457 -14.3457 -14.0831 -14.0831 -13.8670 -13.8670 -13.7320 -13.7320 -9.7742 -9.7742 -9.6600 -9.6600 -7.4122 -7.4122 -7.2770 -7.2770 2.5919 2.5919 2.8767 2.8767 3.1972 3.1972 3.2475 3.2475 3.5123 3.5123 3.8037 3.8037 4.1185 4.1185 4.4440 4.4440 4.8464 4.8464 4.9647 4.9647 5.1425 5.1425 5.4076 5.4076 10.6629 10.6629 11.4946 11.4946 12.0554 12.0554 12.1842 12.1842 12.7722 12.7722 k = 0.6501-0.2571-0.5946 ( 4214 PWs) bands (ev): -34.2178 -34.2178 -34.1807 -34.1807 -15.5202 -15.5202 -15.3194 -15.3194 -14.3330 -14.3330 -14.0711 -14.0711 -13.8610 -13.8610 -13.7285 -13.7285 -9.7997 -9.7997 -9.6879 -9.6879 -7.4202 -7.4202 -7.2789 -7.2789 2.5794 2.5794 2.8798 2.8798 3.1885 3.1885 3.2248 3.2248 3.5591 3.5591 3.7702 3.7702 4.1529 4.1529 4.4195 4.4195 4.8692 4.8692 4.9819 4.9819 5.1498 5.1498 5.4209 5.4209 10.6836 10.6836 11.4736 11.4736 12.0052 12.0052 12.1667 12.1667 12.7503 12.7503 k = 0.6441-0.2428-0.5685 ( 4212 PWs) bands (ev): -34.2195 -34.2195 -34.1813 -34.1813 -15.5119 -15.5119 -15.3079 -15.3079 -14.3206 -14.3206 -14.0582 -14.0582 -13.8547 -13.8547 -13.7251 -13.7251 -9.8259 -9.8259 -9.7164 -9.7164 -7.4280 -7.4280 -7.2806 -7.2806 2.5684 2.5684 2.8836 2.8836 3.1777 3.1777 3.2035 3.2035 3.6034 3.6034 3.7377 3.7377 4.1898 4.1898 4.3962 4.3962 4.8924 4.8924 4.9991 4.9991 5.1550 5.1550 5.4334 5.4334 10.7014 10.7014 11.4523 11.4523 11.9547 11.9547 12.1507 12.1507 12.7252 12.7252 k = 0.6381-0.2285-0.5423 ( 4210 PWs) bands (ev): -34.2212 -34.2212 -34.1820 -34.1820 -15.5039 -15.5039 -15.2963 -15.2963 -14.3087 -14.3087 -14.0444 -14.0444 -13.8481 -13.8481 -13.7220 -13.7220 -9.8525 -9.8525 -9.7452 -9.7452 -7.4354 -7.4354 -7.2819 -7.2819 2.5590 2.5590 2.8881 2.8881 3.1632 3.1632 3.1856 3.1856 3.6374 3.6374 3.7132 3.7132 4.2285 4.2285 4.3755 4.3755 4.9158 4.9158 5.0160 5.0160 5.1582 5.1582 5.4452 5.4452 10.7166 10.7166 11.4309 11.4309 11.9041 11.9041 12.1360 12.1360 12.6971 12.6971 k = 0.6321-0.2142-0.5161 ( 4214 PWs) bands (ev): -34.2229 -34.2229 -34.1827 -34.1827 -15.4962 -15.4962 -15.2846 -15.2846 -14.2972 -14.2972 -14.0297 -14.0297 -13.8412 -13.8412 -13.7191 -13.7191 -9.8795 -9.8795 -9.7743 -9.7743 -7.4424 -7.4424 -7.2830 -7.2830 2.5515 2.5515 2.8932 2.8932 3.1445 3.1445 3.1719 3.1719 3.6366 3.6366 3.7196 3.7196 4.2679 4.2679 4.3597 4.3597 4.9390 4.9390 5.0324 5.0324 5.1599 5.1599 5.4562 5.4562 10.7296 10.7296 11.4099 11.4099 11.8538 11.8538 12.1225 12.1225 12.6661 12.6661 k = 0.6261-0.1999-0.4899 ( 4226 PWs) bands (ev): -34.2245 -34.2245 -34.1834 -34.1834 -15.4889 -15.4889 -15.2729 -15.2729 -14.2861 -14.2861 -14.0144 -14.0144 -13.8339 -13.8339 -13.7164 -13.7164 -9.9069 -9.9069 -9.8036 -9.8036 -7.4491 -7.4491 -7.2838 -7.2838 2.5459 2.5459 2.8988 2.8988 3.1239 3.1239 3.1605 3.1605 3.6087 3.6087 3.7473 3.7473 4.3049 4.3049 4.3539 4.3539 4.9619 4.9619 5.0477 5.0477 5.1607 5.1607 5.4663 5.4663 10.7406 10.7406 11.3895 11.3895 11.8041 11.8041 12.1101 12.1101 12.6325 12.6325 k = 0.6201-0.1856-0.4638 ( 4220 PWs) bands (ev): -34.2261 -34.2261 -34.1841 -34.1841 -15.4819 -15.4819 -15.2614 -15.2614 -14.2754 -14.2754 -13.9986 -13.9986 -13.8262 -13.8262 -13.7139 -13.7139 -9.9343 -9.9343 -9.8330 -9.8330 -7.4553 -7.4553 -7.2844 -7.2844 2.5425 2.5425 2.9048 2.9048 3.1031 3.1031 3.1501 3.1501 3.5751 3.5751 3.7725 3.7725 4.3276 4.3276 4.3716 4.3716 4.9840 4.9840 5.0612 5.0612 5.1616 5.1616 5.4756 5.4756 10.7501 10.7501 11.3700 11.3700 11.7556 11.7556 12.0986 12.0986 12.5965 12.5965 k = 0.6141-0.1713-0.4376 ( 4220 PWs) bands (ev): -34.2277 -34.2277 -34.1848 -34.1848 -15.4752 -15.4752 -15.2500 -15.2500 -14.2651 -14.2651 -13.9822 -13.9822 -13.8182 -13.8182 -13.7116 -13.7116 -9.9619 -9.9619 -9.8624 -9.8624 -7.4612 -7.4612 -7.2847 -7.2847 2.5412 2.5412 2.9108 2.9108 3.0831 3.0831 3.1403 3.1403 3.5405 3.5405 3.7884 3.7884 4.3414 4.3414 4.4094 4.4094 5.0050 5.0050 5.0717 5.0717 5.1637 5.1637 5.4840 5.4840 10.7585 10.7585 11.3516 11.3516 11.7083 11.7083 12.0878 12.0878 12.5583 12.5583 k = 0.6081-0.1569-0.4114 ( 4224 PWs) bands (ev): -34.2292 -34.2292 -34.1855 -34.1855 -15.4689 -15.4689 -15.2390 -15.2390 -14.2552 -14.2552 -13.9656 -13.9656 -13.8099 -13.8099 -13.7095 -13.7095 -9.9893 -9.9893 -9.8917 -9.8917 -7.4667 -7.4667 -7.2847 -7.2847 2.5420 2.5420 2.9163 2.9163 3.0646 3.0646 3.1309 3.1309 3.5061 3.5061 3.7927 3.7927 4.3625 4.3625 4.4516 4.4516 5.0245 5.0245 5.0787 5.0787 5.1685 5.1685 5.4914 5.4914 10.7659 10.7659 11.3344 11.3344 11.6628 11.6628 12.0776 12.0776 12.5182 12.5182 k = 0.6021-0.1426-0.3853 ( 4226 PWs) bands (ev): -34.2307 -34.2307 -34.1862 -34.1862 -15.4629 -15.4629 -15.2283 -15.2283 -14.2457 -14.2457 -13.9489 -13.9489 -13.8012 -13.8012 -13.7076 -13.7076 -10.0166 -10.0166 -9.9207 -9.9207 -7.4717 -7.4717 -7.2845 -7.2845 2.5452 2.5452 2.9205 2.9205 3.0486 3.0486 3.1220 3.1220 3.4723 3.4723 3.7856 3.7856 4.3938 4.3938 4.4943 4.4943 5.0412 5.0412 5.0828 5.0828 5.1765 5.1765 5.4978 5.4978 10.7727 10.7727 11.3187 11.3187 11.6193 11.6193 12.0678 12.0678 12.4766 12.4766 k = 0.5961-0.1283-0.3591 ( 4226 PWs) bands (ev): -34.2321 -34.2321 -34.1869 -34.1869 -15.4573 -15.4573 -15.2180 -15.2180 -14.2367 -14.2367 -13.9320 -13.9320 -13.7922 -13.7922 -13.7058 -13.7058 -10.0434 -10.0434 -9.9492 -9.9492 -7.4763 -7.4763 -7.2841 -7.2841 2.5505 2.5505 2.9223 2.9223 3.0362 3.0362 3.1137 3.1137 3.4396 3.4396 3.7683 3.7683 4.4344 4.4344 4.5361 4.5361 5.0522 5.0522 5.0877 5.0877 5.1874 5.1874 5.5030 5.5030 10.7792 10.7792 11.3047 11.3047 11.5779 11.5779 12.0581 12.0581 12.4337 12.4337 k = 0.5901-0.1140-0.3329 ( 4224 PWs) bands (ev): -34.2334 -34.2334 -34.1875 -34.1875 -15.4520 -15.4520 -15.2081 -15.2081 -14.2280 -14.2280 -13.9153 -13.9153 -13.7831 -13.7831 -13.7043 -13.7043 -10.0698 -10.0698 -9.9772 -9.9772 -7.4806 -7.4806 -7.2836 -7.2836 2.5581 2.5581 2.9204 2.9204 3.0285 3.0285 3.1063 3.1063 3.4081 3.4081 3.7432 3.7432 4.4821 4.4821 4.5760 4.5760 5.0551 5.0551 5.0974 5.0974 5.1999 5.1999 5.5070 5.5070 10.7854 10.7854 11.2924 11.2924 11.5390 11.5390 12.0485 12.0485 12.3900 12.3900 k = 0.5841-0.0997-0.3067 ( 4226 PWs) bands (ev): -34.2347 -34.2347 -34.1881 -34.1881 -15.4471 -15.4471 -15.1988 -15.1988 -14.2198 -14.2198 -13.8988 -13.8988 -13.7738 -13.7738 -13.7028 -13.7028 -10.0955 -10.0955 -10.0045 -10.0045 -7.4845 -7.4845 -7.2829 -7.2829 2.5679 2.5679 2.9144 2.9144 3.0257 3.0257 3.1000 3.1000 3.3780 3.3780 3.7120 3.7120 4.5349 4.5349 4.6131 4.6131 5.0529 5.0529 5.1105 5.1105 5.2133 5.2133 5.5095 5.5095 10.7916 10.7916 11.2819 11.2819 11.5026 11.5026 12.0387 12.0387 12.3460 12.3460 k = 0.5780-0.0854-0.2806 ( 4226 PWs) bands (ev): -34.2359 -34.2359 -34.1887 -34.1887 -15.4426 -15.4426 -15.1900 -15.1900 -14.2121 -14.2121 -13.8827 -13.8827 -13.7645 -13.7645 -13.7015 -13.7015 -10.1203 -10.1203 -10.0310 -10.0310 -7.4879 -7.4879 -7.2821 -7.2821 2.5797 2.5797 2.9050 2.9050 3.0269 3.0269 3.0951 3.0951 3.3494 3.3494 3.6766 3.6766 4.5910 4.5910 4.6462 4.6462 5.0498 5.0498 5.1244 5.1244 5.2269 5.2269 5.5105 5.5105 10.7978 10.7978 11.2734 11.2734 11.4691 11.4691 12.0285 12.0285 12.3021 12.3021 k = 0.5720-0.0711-0.2544 ( 4226 PWs) bands (ev): -34.2371 -34.2371 -34.1893 -34.1893 -15.4384 -15.4384 -15.1818 -15.1818 -14.2048 -14.2048 -13.8670 -13.8670 -13.7554 -13.7554 -13.7002 -13.7002 -10.1441 -10.1441 -10.0563 -10.0563 -7.4911 -7.4911 -7.2812 -7.2812 2.5937 2.5937 2.8934 2.8934 3.0300 3.0300 3.0922 3.0922 3.3225 3.3225 3.6382 3.6382 4.6484 4.6484 4.6749 4.6749 5.0484 5.0484 5.1378 5.1378 5.2400 5.2400 5.5098 5.5098 10.8039 10.8039 11.2667 11.2667 11.4383 11.4383 12.0176 12.0176 12.2591 12.2591 k = 0.5660-0.0568-0.2282 ( 4230 PWs) bands (ev): -34.2381 -34.2381 -34.1898 -34.1898 -15.4346 -15.4346 -15.1742 -15.1742 -14.1981 -14.1981 -13.8518 -13.8518 -13.7466 -13.7466 -13.6989 -13.6989 -10.1667 -10.1667 -10.0805 -10.0805 -7.4939 -7.4939 -7.2802 -7.2802 2.6095 2.6095 2.8808 2.8808 3.0332 3.0332 3.0922 3.0922 3.2974 3.2974 3.5980 3.5980 4.6919 4.6919 4.7122 4.7122 5.0503 5.0503 5.1505 5.1505 5.2526 5.2526 5.5071 5.5071 10.8101 10.8101 11.2620 11.2620 11.4105 11.4105 12.0057 12.0057 12.2176 12.2176 k = 0.5600-0.0425-0.2021 ( 4224 PWs) bands (ev): -34.2391 -34.2391 -34.1903 -34.1903 -15.4311 -15.4311 -15.1672 -15.1672 -14.1920 -14.1920 -13.8373 -13.8373 -13.7385 -13.7385 -13.6974 -13.6974 -10.1880 -10.1880 -10.1033 -10.1033 -7.4963 -7.4963 -7.2792 -7.2792 2.6270 2.6270 2.8682 2.8682 3.0350 3.0350 3.0953 3.0953 3.2742 3.2742 3.5567 3.5567 4.7084 4.7084 4.7699 4.7699 5.0563 5.0563 5.1625 5.1625 5.2642 5.2642 5.5023 5.5023 10.8163 10.8163 11.2591 11.2591 11.3857 11.3857 11.9924 11.9924 12.1785 12.1785 k = 0.5540-0.0282-0.1759 ( 4228 PWs) bands (ev): -34.2400 -34.2400 -34.1907 -34.1907 -15.4280 -15.4280 -15.1609 -15.1609 -14.1864 -14.1864 -13.8235 -13.8235 -13.7314 -13.7314 -13.6955 -13.6955 -10.2078 -10.2078 -10.1246 -10.1246 -7.4985 -7.4985 -7.2782 -7.2782 2.6461 2.6461 2.8560 2.8560 3.0350 3.0350 3.1013 3.1013 3.2530 3.2530 3.5150 3.5150 4.7168 4.7168 4.8284 4.8284 5.0664 5.0664 5.1736 5.1736 5.2747 5.2747 5.4953 5.4953 10.8223 10.8223 11.2579 11.2579 11.3638 11.3638 11.9773 11.9773 12.1428 12.1428 k = 0.5480-0.0138-0.1497 ( 4228 PWs) bands (ev): -34.2408 -34.2408 -34.1912 -34.1912 -15.4252 -15.4252 -15.1552 -15.1552 -14.1813 -14.1813 -13.8106 -13.8106 -13.7257 -13.7257 -13.6930 -13.6930 -10.2260 -10.2260 -10.1441 -10.1441 -7.5004 -7.5004 -7.2772 -7.2772 2.6663 2.6663 2.8446 2.8446 3.0338 3.0338 3.1093 3.1093 3.2338 3.2338 3.4738 3.4738 4.7193 4.7193 4.8859 4.8859 5.0799 5.0799 5.1841 5.1841 5.2838 5.2838 5.4860 5.4860 10.8280 10.8280 11.2583 11.2583 11.3448 11.3448 11.9600 11.9600 12.1114 12.1114 k = 0.5420 0.0005-0.1235 ( 4222 PWs) bands (ev): -34.2416 -34.2416 -34.1915 -34.1915 -15.4227 -15.4227 -15.1502 -15.1502 -14.1769 -14.1769 -13.7985 -13.7985 -13.7217 -13.7217 -13.6897 -13.6897 -10.2423 -10.2423 -10.1618 -10.1618 -7.5020 -7.5020 -7.2763 -7.2763 2.6874 2.6874 2.8343 2.8343 3.0318 3.0318 3.1181 3.1181 3.2167 3.2167 3.4336 3.4336 4.7174 4.7174 4.9415 4.9415 5.0955 5.0955 5.1940 5.1940 5.2916 5.2916 5.4740 5.4740 10.8334 10.8334 11.2599 11.2599 11.3288 11.3288 11.9405 11.9405 12.0849 12.0849 k = 0.5360 0.0148-0.0974 ( 4222 PWs) bands (ev): -34.2422 -34.2422 -34.1919 -34.1919 -15.4206 -15.4206 -15.1459 -15.1459 -14.1730 -14.1730 -13.7874 -13.7874 -13.7194 -13.7194 -13.6858 -13.6858 -10.2568 -10.2568 -10.1775 -10.1775 -7.5033 -7.5033 -7.2755 -7.2755 2.7086 2.7086 2.8253 2.8253 3.0296 3.0296 3.1269 3.1269 3.2019 3.2019 3.3952 3.3952 4.7127 4.7127 4.9945 4.9945 5.1120 5.1120 5.2035 5.2035 5.2977 5.2977 5.4596 5.4596 10.8383 10.8383 11.2625 11.2625 11.3156 11.3156 11.9195 11.9195 12.0632 12.0632 k = 0.5300 0.0291-0.0712 ( 4226 PWs) bands (ev): -34.2427 -34.2427 -34.1921 -34.1921 -15.4189 -15.4189 -15.1422 -15.1422 -14.1697 -14.1697 -13.7774 -13.7774 -13.7185 -13.7185 -13.6817 -13.6817 -10.2693 -10.2693 -10.1910 -10.1910 -7.5045 -7.5045 -7.2747 -7.2747 2.7293 2.7293 2.8179 2.8179 3.0275 3.0275 3.1350 3.1350 3.1895 3.1895 3.3595 3.3595 4.7065 4.7065 5.0434 5.0434 5.1291 5.1291 5.2127 5.2127 5.3021 5.3021 5.4426 5.4426 10.8425 10.8425 11.2655 11.2655 11.3051 11.3051 11.8984 11.8984 12.0456 12.0456 k = 0.5240 0.0434-0.0450 ( 4230 PWs) bands (ev): -34.2432 -34.2432 -34.1924 -34.1924 -15.4174 -15.4174 -15.1392 -15.1392 -14.1671 -14.1671 -13.7686 -13.7686 -13.7187 -13.7187 -13.6778 -13.6778 -10.2796 -10.2796 -10.2023 -10.2023 -7.5054 -7.5054 -7.2741 -7.2741 2.7482 2.7482 2.8124 2.8124 3.0256 3.0256 3.1416 3.1416 3.1796 3.1796 3.3275 3.3275 4.7001 4.7001 5.0856 5.0856 5.1480 5.1480 5.2214 5.2214 5.3044 5.3044 5.4234 5.4234 10.8461 10.8461 11.2686 11.2686 11.2973 11.2973 11.8785 11.8785 12.0311 12.0311 k = 0.5180 0.0577-0.0188 ( 4226 PWs) bands (ev): -34.2435 -34.2435 -34.1925 -34.1925 -15.4163 -15.4163 -15.1368 -15.1368 -14.1650 -14.1650 -13.7610 -13.7610 -13.7197 -13.7197 -13.6744 -13.6744 -10.2877 -10.2877 -10.2112 -10.2112 -7.5061 -7.5061 -7.2736 -7.2736 2.7639 2.7639 2.8094 2.8094 3.0240 3.0240 3.1462 3.1462 3.1727 3.1727 3.3006 3.3006 4.6942 4.6942 5.1155 5.1155 5.1732 5.1732 5.2293 5.2293 5.3043 5.3043 5.4028 5.4028 10.8489 10.8489 11.2708 11.2708 11.2922 11.2922 11.8614 11.8614 12.0194 12.0194 k = 0.5120 0.0720 0.0073 ( 4228 PWs) bands (ev): -34.2438 -34.2438 -34.1927 -34.1927 -15.4155 -15.4155 -15.1352 -15.1352 -14.1635 -14.1635 -13.7550 -13.7550 -13.7210 -13.7210 -13.6719 -13.6719 -10.2936 -10.2936 -10.2176 -10.2176 -7.5065 -7.5065 -7.2732 -7.2732 2.7744 2.7744 2.8094 2.8094 3.0229 3.0229 3.1481 3.1481 3.1691 3.1691 3.2799 3.2799 4.6895 4.6895 5.1317 5.1317 5.2051 5.2051 5.2361 5.2361 5.3003 5.3003 5.3828 5.3828 10.8510 10.8510 11.2719 11.2719 11.2897 11.2897 11.8483 11.8483 12.0108 12.0108 k = 0.5060 0.0863 0.0335 ( 4232 PWs) bands (ev): -34.2439 -34.2439 -34.1928 -34.1928 -15.4150 -15.4150 -15.1342 -15.1342 -14.1626 -14.1626 -13.7510 -13.7510 -13.7222 -13.7222 -13.6703 -13.6703 -10.2971 -10.2971 -10.2214 -10.2214 -7.5068 -7.5068 -7.2730 -7.2730 2.7793 2.7793 2.8115 2.8115 3.0223 3.0223 3.1481 3.1481 3.1680 3.1680 3.2669 3.2669 4.6865 4.6865 5.1392 5.1392 5.2331 5.2331 5.2453 5.2453 5.2897 5.2897 5.3673 5.3673 10.8522 10.8522 11.2720 11.2720 11.2890 11.2890 11.8401 11.8401 12.0056 12.0056 k = 0.5000 0.1006 0.0597 ( 4238 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1338 -15.1338 -14.1623 -14.1623 -13.7496 -13.7496 -13.7227 -13.7227 -13.6698 -13.6698 -10.2983 -10.2983 -10.2227 -10.2227 -7.5069 -7.5069 -7.2729 -7.2729 2.7806 2.7806 2.8127 2.8127 3.0220 3.0220 3.1479 3.1479 3.1678 3.1678 3.2624 3.2624 4.6855 4.6855 5.1415 5.1415 5.2385 5.2385 5.2675 5.2675 5.2719 5.2719 5.3615 5.3615 10.8526 10.8526 11.2720 11.2720 11.2889 11.2889 11.8373 11.8373 12.0039 12.0039 k = 0.5000 0.1006 0.0597 ( 4238 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1338 -15.1338 -14.1623 -14.1623 -13.7496 -13.7496 -13.7227 -13.7227 -13.6698 -13.6698 -10.2983 -10.2983 -10.2227 -10.2227 -7.5069 -7.5069 -7.2729 -7.2729 2.7806 2.7806 2.8127 2.8127 3.0220 3.0220 3.1479 3.1479 3.1678 3.1678 3.2624 3.2624 4.6855 4.6855 5.1415 5.1415 5.2385 5.2385 5.2675 5.2675 5.2719 5.2719 5.3615 5.3615 10.8526 10.8526 11.2720 11.2720 11.2889 11.2889 11.8373 11.8373 12.0039 12.0039 k = 0.4706 0.0947 0.0562 ( 4238 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1339 -15.1339 -14.1623 -14.1623 -13.7496 -13.7496 -13.7227 -13.7227 -13.6698 -13.6698 -10.2983 -10.2983 -10.2227 -10.2227 -7.5065 -7.5065 -7.2734 -7.2734 2.7805 2.7805 2.8127 2.8127 3.0187 3.0187 3.1481 3.1481 3.1679 3.1679 3.2673 3.2673 4.6798 4.6798 5.1421 5.1421 5.2388 5.2388 5.2647 5.2647 5.2785 5.2785 5.3613 5.3613 10.8514 10.8514 11.2720 11.2720 11.2890 11.2890 11.8339 11.8339 12.0033 12.0033 k = 0.4412 0.0888 0.0527 ( 4235 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1338 -15.1338 -14.1623 -14.1623 -13.7496 -13.7496 -13.7227 -13.7227 -13.6698 -13.6698 -10.2982 -10.2982 -10.2228 -10.2228 -7.5050 -7.5050 -7.2748 -7.2748 2.7804 2.7804 2.8126 2.8126 3.0093 3.0093 3.1487 3.1487 3.1680 3.1680 3.2814 3.2814 4.6634 4.6634 5.1436 5.1436 5.2395 5.2395 5.2622 5.2622 5.2919 5.2919 5.3605 5.3605 10.8479 10.8479 11.2722 11.2722 11.2892 11.2892 11.8239 11.8239 12.0017 12.0017 k = 0.4118 0.0829 0.0491 ( 4217 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1338 -15.1338 -14.1623 -14.1623 -13.7496 -13.7496 -13.7227 -13.7227 -13.6698 -13.6698 -10.2982 -10.2982 -10.2230 -10.2230 -7.5027 -7.5027 -7.2770 -7.2770 2.7802 2.7802 2.8124 2.8124 2.9959 2.9959 3.1493 3.1493 3.1682 3.1682 3.3030 3.3030 4.6376 4.6376 5.1458 5.1458 5.2407 5.2407 5.2601 5.2601 5.3108 5.3108 5.3593 5.3593 10.8420 10.8420 11.2726 11.2726 11.2896 11.2896 11.8084 11.8084 11.9992 11.9992 k = 0.3824 0.0770 0.0456 ( 4217 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1338 -15.1338 -14.1623 -14.1623 -13.7496 -13.7496 -13.7226 -13.7226 -13.6698 -13.6698 -10.2982 -10.2982 -10.2232 -10.2232 -7.4994 -7.4994 -7.2802 -7.2802 2.7799 2.7799 2.8121 2.8121 2.9803 2.9803 3.1501 3.1501 3.1686 3.1686 3.3303 3.3303 4.6043 4.6043 5.1484 5.1484 5.2423 5.2423 5.2581 5.2581 5.3341 5.3341 5.3576 5.3576 10.8338 10.8338 11.2730 11.2730 11.2900 11.2900 11.7888 11.7888 11.9961 11.9961 k = 0.3529 0.0710 0.0421 ( 4211 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1338 -15.1338 -14.1624 -14.1624 -13.7496 -13.7496 -13.7226 -13.7226 -13.6698 -13.6698 -10.2982 -10.2982 -10.2234 -10.2234 -7.4953 -7.4953 -7.2843 -7.2843 2.7795 2.7795 2.8117 2.8117 2.9637 2.9637 3.1507 3.1507 3.1690 3.1690 3.3620 3.3620 4.5651 4.5651 5.1512 5.1512 5.2444 5.2444 5.2559 5.2559 5.3554 5.3554 5.3605 5.3605 10.8234 10.8234 11.2736 11.2736 11.2907 11.2907 11.7669 11.7669 11.9925 11.9925 k = 0.3235 0.0651 0.0386 ( 4217 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1338 -15.1338 -14.1624 -14.1624 -13.7496 -13.7496 -13.7225 -13.7225 -13.6698 -13.6698 -10.2981 -10.2981 -10.2237 -10.2237 -7.4903 -7.4903 -7.2891 -7.2891 2.7791 2.7791 2.8113 2.8113 2.9471 2.9471 3.1514 3.1514 3.1694 3.1694 3.3970 3.3970 4.5215 4.5215 5.1542 5.1542 5.2469 5.2469 5.2535 5.2535 5.3528 5.3528 5.3885 5.3885 10.8109 10.8109 11.2742 11.2742 11.2914 11.2914 11.7446 11.7446 11.9884 11.9884 k = 0.2941 0.0592 0.0351 ( 4220 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1338 -15.1338 -14.1624 -14.1624 -13.7496 -13.7496 -13.7225 -13.7225 -13.6698 -13.6698 -10.2981 -10.2981 -10.2240 -10.2240 -7.4846 -7.4846 -7.2947 -7.2947 2.7787 2.7787 2.8109 2.8109 2.9311 2.9311 3.1521 3.1521 3.1699 3.1699 3.4348 3.4348 4.4747 4.4747 5.1573 5.1573 5.2498 5.2498 5.2507 5.2507 5.3498 5.3498 5.4171 5.4171 10.7967 10.7967 11.2749 11.2749 11.2921 11.2921 11.7235 11.7235 11.9837 11.9837 k = 0.2647 0.0533 0.0316 ( 4220 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4150 -15.4150 -15.1337 -15.1337 -14.1624 -14.1624 -13.7496 -13.7496 -13.7224 -13.7224 -13.6698 -13.6698 -10.2981 -10.2981 -10.2244 -10.2244 -7.4782 -7.4782 -7.3010 -7.3010 2.7782 2.7782 2.8104 2.8104 2.9160 2.9160 3.1527 3.1527 3.1704 3.1704 3.4747 3.4747 4.4255 4.4255 5.1607 5.1607 5.2477 5.2477 5.2531 5.2531 5.3465 5.3465 5.4451 5.4451 10.7811 10.7811 11.2756 11.2756 11.2929 11.2929 11.7046 11.7046 11.9778 11.9778 k = 0.2353 0.0474 0.0281 ( 4238 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4150 -15.4150 -15.1337 -15.1337 -14.1625 -14.1625 -13.7496 -13.7496 -13.7223 -13.7223 -13.6698 -13.6698 -10.2980 -10.2980 -10.2247 -10.2247 -7.4711 -7.4711 -7.3079 -7.3079 2.7777 2.7777 2.8100 2.8100 2.9022 2.9022 3.1534 3.1534 3.1710 3.1710 3.5165 3.5165 4.3748 4.3748 5.1641 5.1641 5.2443 5.2443 5.2567 5.2567 5.3428 5.3428 5.4719 5.4719 10.7647 10.7647 11.2764 11.2764 11.2937 11.2937 11.6888 11.6888 11.9699 11.9699 k = 0.2059 0.0414 0.0246 ( 4242 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4150 -15.4150 -15.1337 -15.1337 -14.1625 -14.1625 -13.7496 -13.7496 -13.7223 -13.7223 -13.6698 -13.6698 -10.2980 -10.2980 -10.2250 -10.2250 -7.4636 -7.4636 -7.3154 -7.3154 2.7772 2.7772 2.8095 2.8095 2.8898 2.8898 3.1540 3.1540 3.1715 3.1715 3.5597 3.5597 4.3232 4.3232 5.1678 5.1678 5.2408 5.2408 5.2605 5.2605 5.3388 5.3388 5.4968 5.4968 10.7481 10.7481 11.2772 11.2772 11.2946 11.2946 11.6762 11.6762 11.9595 11.9595 k = 0.1765 0.0355 0.0211 ( 4239 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4150 -15.4150 -15.1337 -15.1337 -14.1625 -14.1625 -13.7496 -13.7496 -13.7222 -13.7222 -13.6698 -13.6698 -10.2979 -10.2979 -10.2253 -10.2253 -7.4556 -7.4556 -7.3232 -7.3232 2.7768 2.7768 2.8091 2.8091 2.8789 2.8789 3.1545 3.1545 3.1720 3.1720 3.6041 3.6041 4.2711 4.2711 5.1715 5.1715 5.2372 5.2372 5.2645 5.2645 5.3347 5.3347 5.5194 5.5194 10.7319 10.7319 11.2779 11.2779 11.2954 11.2954 11.6668 11.6668 11.9473 11.9473 k = 0.1471 0.0296 0.0176 ( 4245 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4151 -15.4151 -15.1337 -15.1337 -14.1626 -14.1626 -13.7496 -13.7496 -13.7222 -13.7222 -13.6698 -13.6698 -10.2979 -10.2979 -10.2256 -10.2256 -7.4474 -7.4474 -7.3313 -7.3313 2.7763 2.7763 2.8087 2.8087 2.8695 2.8695 3.1550 3.1550 3.1724 3.1724 3.6491 3.6491 4.2194 4.2194 5.1752 5.1752 5.2335 5.2335 5.2687 5.2687 5.3304 5.3304 5.5391 5.5391 10.7169 10.7169 11.2786 11.2786 11.2961 11.2961 11.6604 11.6604 11.9348 11.9348 k = 0.1176 0.0237 0.0140 ( 4254 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4151 -15.4151 -15.1337 -15.1337 -14.1626 -14.1626 -13.7496 -13.7496 -13.7221 -13.7221 -13.6698 -13.6698 -10.2979 -10.2979 -10.2259 -10.2259 -7.4393 -7.4393 -7.3393 -7.3393 2.7760 2.7760 2.8083 2.8083 2.8618 2.8618 3.1554 3.1554 3.1728 3.1728 3.6942 3.6942 4.1687 4.1687 5.1789 5.1789 5.2298 5.2298 5.2728 5.2728 5.3262 5.3262 5.5557 5.5557 10.7036 10.7036 11.2793 11.2793 11.2967 11.2967 11.6563 11.6563 11.9231 11.9231 k = 0.0882 0.0178 0.0105 ( 4260 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4151 -15.4151 -15.1337 -15.1337 -14.1626 -14.1626 -13.7496 -13.7496 -13.7221 -13.7221 -13.6698 -13.6698 -10.2979 -10.2979 -10.2261 -10.2261 -7.4315 -7.4315 -7.3471 -7.3471 2.7757 2.7757 2.8080 2.8080 2.8558 2.8558 3.1558 3.1558 3.1731 3.1731 3.7380 3.7380 4.1203 4.1203 5.1823 5.1823 5.2264 5.2264 5.2768 5.2768 5.3222 5.3222 5.5689 5.5689 10.6927 10.6927 11.2798 11.2798 11.2972 11.2972 11.6541 11.6541 11.9130 11.9130 k = 0.0588 0.0118 0.0070 ( 4260 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4151 -15.4151 -15.1337 -15.1337 -14.1626 -14.1626 -13.7496 -13.7496 -13.7221 -13.7221 -13.6698 -13.6698 -10.2978 -10.2978 -10.2262 -10.2262 -7.4246 -7.4246 -7.3538 -7.3538 2.7754 2.7754 2.8078 2.8078 2.8515 2.8515 3.1560 3.1560 3.1734 3.1734 3.7784 3.7784 4.0767 4.0767 5.1852 5.1852 5.2235 5.2235 5.2802 5.2802 5.3187 5.3187 5.5784 5.5784 10.6845 10.6845 11.2802 11.2802 11.2976 11.2976 11.6531 11.6531 11.9052 11.9052 k = 0.0294 0.0059 0.0035 ( 4254 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4151 -15.4151 -15.1337 -15.1337 -14.1626 -14.1626 -13.7496 -13.7496 -13.7220 -13.7220 -13.6698 -13.6698 -10.2978 -10.2978 -10.2263 -10.2263 -7.4197 -7.4197 -7.3587 -7.3587 2.7753 2.7753 2.8077 2.8077 2.8489 2.8489 3.1562 3.1562 3.1735 3.1735 3.8098 3.8098 4.0433 4.0433 5.1872 5.1872 5.2215 5.2215 5.2827 5.2827 5.3162 5.3162 5.5842 5.5842 10.6795 10.6795 11.2804 11.2804 11.2979 11.2979 11.6527 11.6527 11.9003 11.9003 k = 0.0000 0.0000 0.0000 ( 4257 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4151 -15.4151 -15.1337 -15.1337 -14.1626 -14.1626 -13.7496 -13.7496 -13.7220 -13.7220 -13.6698 -13.6698 -10.2978 -10.2978 -10.2264 -10.2264 -7.4178 -7.4178 -7.3606 -7.3606 2.7752 2.7752 2.8077 2.8077 2.8480 2.8480 3.1563 3.1563 3.1736 3.1736 3.8226 3.8226 4.0299 4.0299 5.1880 5.1880 5.2207 5.2207 5.2836 5.2836 5.3153 5.3153 5.5861 5.5861 10.6777 10.6777 11.2805 11.2805 11.2979 11.2979 11.6527 11.6527 11.8986 11.8986 k = 0.0000 0.0000 0.0000 ( 4257 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4151 -15.4151 -15.1337 -15.1337 -14.1626 -14.1626 -13.7496 -13.7496 -13.7220 -13.7220 -13.6698 -13.6698 -10.2978 -10.2978 -10.2264 -10.2264 -7.4178 -7.4178 -7.3606 -7.3606 2.7752 2.7752 2.8077 2.8077 2.8480 2.8480 3.1563 3.1563 3.1736 3.1736 3.8226 3.8226 4.0299 4.0299 5.1880 5.1880 5.2207 5.2207 5.2836 5.2836 5.3153 5.3153 5.5861 5.5861 10.6777 10.6777 11.2805 11.2805 11.2979 11.2979 11.6527 11.6527 11.8986 11.8986 k = 0.0059-0.0141-0.0258 ( 4257 PWs) bands (ev): -34.2439 -34.2439 -34.1928 -34.1928 -15.4153 -15.4153 -15.1340 -15.1340 -14.1629 -14.1629 -13.7510 -13.7510 -13.7216 -13.7216 -13.6703 -13.6703 -10.2967 -10.2967 -10.2251 -10.2251 -7.4179 -7.4179 -7.3606 -7.3606 2.7753 2.7753 2.8077 2.8077 2.8477 2.8477 3.1561 3.1561 3.1736 3.1736 3.8233 3.8233 4.0329 4.0329 5.1862 5.1862 5.2189 5.2189 5.2822 5.2822 5.3136 5.3136 5.5865 5.5865 10.6792 10.6792 11.2804 11.2804 11.2979 11.2979 11.6557 11.6557 11.8907 11.8907 k = 0.0119-0.0283-0.0517 ( 4259 PWs) bands (ev): -34.2438 -34.2438 -34.1927 -34.1927 -15.4157 -15.4157 -15.1350 -15.1350 -14.1638 -14.1638 -13.7549 -13.7549 -13.7204 -13.7204 -13.6719 -13.6719 -10.2933 -10.2933 -10.2213 -10.2213 -7.4179 -7.4179 -7.3605 -7.3605 2.7755 2.7755 2.8081 2.8081 2.8465 2.8465 3.1549 3.1549 3.1745 3.1745 3.8255 3.8255 4.0419 4.0419 5.1810 5.1810 5.2132 5.2132 5.2780 5.2780 5.3087 5.3087 5.5874 5.5874 10.6836 10.6836 11.2797 11.2797 11.2982 11.2982 11.6646 11.6646 11.8757 11.8757 k = 0.0178-0.0424-0.0775 ( 4261 PWs) bands (ev): -34.2435 -34.2435 -34.1926 -34.1926 -15.4165 -15.4165 -15.1366 -15.1366 -14.1652 -14.1652 -13.7607 -13.7607 -13.7191 -13.7191 -13.6743 -13.6743 -10.2876 -10.2876 -10.2150 -10.2150 -7.4180 -7.4180 -7.3603 -7.3603 2.7752 2.7752 2.8092 2.8092 2.8447 2.8447 3.1511 3.1511 3.1783 3.1783 3.8290 3.8290 4.0566 4.0566 5.1721 5.1721 5.2036 5.2036 5.2714 5.2714 5.3011 5.3011 5.5887 5.5887 10.6907 10.6907 11.2777 11.2777 11.2999 11.2999 11.6786 11.6786 11.8623 11.8623 k = 0.0237-0.0565-0.1034 ( 4253 PWs) bands (ev): -34.2432 -34.2432 -34.1924 -34.1924 -15.4176 -15.4176 -15.1389 -15.1389 -14.1673 -14.1673 -13.7680 -13.7680 -13.7182 -13.7182 -13.6776 -13.6776 -10.2797 -10.2797 -10.2063 -10.2063 -7.4180 -7.4180 -7.3601 -7.3601 2.7740 2.7740 2.8117 2.8117 2.8420 2.8420 3.1446 3.1446 3.1853 3.1853 3.8336 3.8336 4.0765 4.0765 5.1594 5.1594 5.1896 5.1896 5.2627 5.2627 5.2916 5.2916 5.5901 5.5901 10.7003 10.7003 11.2744 11.2744 11.3035 11.3035 11.6967 11.6967 11.8542 11.8542 k = 0.0296-0.0706-0.1292 ( 4245 PWs) bands (ev): -34.2428 -34.2428 -34.1922 -34.1922 -15.4190 -15.4190 -15.1418 -15.1418 -14.1699 -14.1699 -13.7767 -13.7767 -13.7180 -13.7180 -13.6814 -13.6814 -10.2696 -10.2696 -10.1952 -10.1952 -7.4181 -7.4181 -7.3597 -7.3597 2.7716 2.7716 2.8159 2.8159 2.8388 2.8388 3.1365 3.1365 3.1951 3.1951 3.8390 3.8390 4.1010 4.1010 5.1427 5.1427 5.1713 5.1713 5.2521 5.2521 5.2810 5.2810 5.5913 5.5913 10.7117 10.7117 11.2706 11.2706 11.3085 11.3085 11.7179 11.7179 11.8531 11.8531 k = 0.0356-0.0848-0.1551 ( 4247 PWs) bands (ev): -34.2422 -34.2422 -34.1919 -34.1919 -15.4207 -15.4207 -15.1454 -15.1454 -14.1730 -14.1730 -13.7865 -13.7865 -13.7189 -13.7189 -13.6855 -13.6855 -10.2575 -10.2575 -10.1819 -10.1819 -7.4182 -7.4182 -7.3593 -7.3593 2.7679 2.7679 2.8211 2.8211 2.8355 2.8355 3.1276 3.1276 3.2075 3.2075 3.8448 3.8448 4.1293 4.1293 5.1218 5.1218 5.1488 5.1488 5.2400 5.2400 5.2701 5.2701 5.5920 5.5920 10.7246 10.7246 11.2669 11.2669 11.3148 11.3148 11.7411 11.7411 11.8598 11.8598 k = 0.0415-0.0989-0.1809 ( 4241 PWs) bands (ev): -34.2416 -34.2416 -34.1916 -34.1916 -15.4228 -15.4228 -15.1496 -15.1496 -14.1768 -14.1768 -13.7973 -13.7973 -13.7211 -13.7211 -13.6893 -13.6893 -10.2435 -10.2435 -10.1665 -10.1665 -7.4183 -7.4183 -7.3588 -7.3588 2.7632 2.7632 2.8233 2.8233 2.8362 2.8362 3.1188 3.1188 3.2222 3.2222 3.8506 3.8506 4.1609 4.1609 5.0963 5.0963 5.1230 5.1230 5.2268 5.2268 5.2590 5.2590 5.5921 5.5921 10.7384 10.7384 11.2640 11.2640 11.3221 11.3221 11.7652 11.7652 11.8749 11.8749 k = 0.0474-0.1130-0.2067 ( 4239 PWs) bands (ev): -34.2409 -34.2409 -34.1912 -34.1912 -15.4251 -15.4251 -15.1545 -15.1545 -14.1811 -14.1811 -13.8091 -13.8091 -13.7250 -13.7250 -13.6926 -13.6926 -10.2275 -10.2275 -10.1491 -10.1491 -7.4183 -7.4183 -7.3582 -7.3582 2.7580 2.7580 2.8192 2.8192 2.8440 2.8440 3.1104 3.1104 3.2391 3.2391 3.8559 3.8559 4.1952 4.1952 5.0656 5.0656 5.0956 5.0956 5.2126 5.2126 5.2473 5.2473 5.5914 5.5914 10.7523 10.7523 11.2623 11.2623 11.3307 11.3307 11.7894 11.7894 11.8984 11.8984 k = 0.0534-0.1272-0.2326 ( 4237 PWs) bands (ev): -34.2401 -34.2401 -34.1908 -34.1908 -15.4278 -15.4278 -15.1601 -15.1601 -14.1860 -14.1860 -13.8218 -13.8218 -13.7305 -13.7305 -13.6951 -13.6951 -10.2098 -10.2098 -10.1298 -10.1298 -7.4182 -7.4182 -7.3574 -7.3574 2.7524 2.7524 2.8126 2.8126 2.8549 2.8549 3.1030 3.1030 3.2582 3.2582 3.8602 3.8602 4.2314 4.2314 5.0292 5.0292 5.0684 5.0684 5.1978 5.1978 5.2350 5.2350 5.5898 5.5898 10.7659 10.7659 11.2621 11.2621 11.3410 11.3410 11.8132 11.8132 11.9300 11.9300 k = 0.0593-0.1413-0.2584 ( 4235 PWs) bands (ev): -34.2392 -34.2392 -34.1904 -34.1904 -15.4309 -15.4309 -15.1662 -15.1662 -14.1915 -14.1915 -13.8353 -13.8353 -13.7375 -13.7375 -13.6969 -13.6969 -10.1905 -10.1905 -10.1089 -10.1089 -7.4181 -7.4181 -7.3564 -7.3564 2.7467 2.7467 2.8049 2.8049 2.8675 2.8675 3.0969 3.0969 3.2794 3.2794 3.8629 3.8629 4.2692 4.2692 4.9876 4.9876 5.0420 5.0420 5.1824 5.1824 5.2216 5.2216 5.5872 5.5872 10.7783 10.7783 11.2636 11.2636 11.3536 11.3536 11.8361 11.8361 11.9696 11.9696 k = 0.0652-0.1554-0.2843 ( 4233 PWs) bands (ev): -34.2383 -34.2383 -34.1899 -34.1899 -15.4342 -15.4342 -15.1730 -15.1730 -14.1975 -14.1975 -13.8495 -13.8495 -13.7454 -13.7454 -13.6984 -13.6984 -10.1697 -10.1697 -10.0865 -10.0865 -7.4178 -7.4178 -7.3553 -7.3553 2.7413 2.7413 2.7966 2.7966 2.8814 2.8814 3.0924 3.0924 3.3026 3.3026 3.8635 3.8635 4.3079 4.3079 4.9418 4.9418 5.0167 5.0167 5.1664 5.1664 5.2072 5.2072 5.5838 5.5838 10.7892 10.7892 11.2668 11.2668 11.3690 11.3690 11.8578 11.8578 12.0166 12.0166 k = 0.0711-0.1696-0.3101 ( 4237 PWs) bands (ev): -34.2372 -34.2372 -34.1894 -34.1894 -15.4380 -15.4380 -15.1805 -15.1805 -14.2040 -14.2040 -13.8644 -13.8644 -13.7540 -13.7540 -13.6997 -13.6997 -10.1475 -10.1475 -10.0626 -10.0626 -7.4174 -7.4174 -7.3540 -7.3540 2.7361 2.7361 2.7880 2.7880 2.8965 2.8965 3.0894 3.0894 3.3276 3.3276 3.8617 3.8617 4.3470 4.3470 4.8926 4.8926 4.9931 4.9931 5.1498 5.1498 5.1915 5.1915 5.5794 5.5794 10.7981 10.7981 11.2719 11.2719 11.3878 11.3878 11.8784 11.8784 12.0704 12.0704 k = 0.0771-0.1837-0.3359 ( 4237 PWs) bands (ev): -34.2361 -34.2361 -34.1888 -34.1888 -15.4420 -15.4420 -15.1885 -15.1885 -14.2111 -14.2111 -13.8798 -13.8798 -13.7630 -13.7630 -13.7010 -13.7010 -10.1242 -10.1242 -10.0376 -10.0376 -7.4169 -7.4169 -7.3524 -7.3524 2.7314 2.7314 2.7793 2.7793 2.9124 2.9124 3.0880 3.0880 3.3546 3.3546 3.8568 3.8568 4.3861 4.3861 4.8410 4.8410 4.9714 4.9714 5.1325 5.1325 5.1744 5.1744 5.5743 5.5743 10.8048 10.8048 11.2788 11.2788 11.4102 11.4102 11.8981 11.8981 12.1304 12.1304 k = 0.0830-0.1978-0.3618 ( 4235 PWs) bands (ev): -34.2349 -34.2349 -34.1882 -34.1882 -15.4464 -15.4464 -15.1971 -15.1971 -14.2186 -14.2186 -13.8957 -13.8957 -13.7722 -13.7722 -13.7023 -13.7023 -10.0999 -10.0999 -10.0115 -10.0115 -7.4161 -7.4161 -7.3506 -7.3506 2.7273 2.7273 2.7709 2.7709 2.9291 2.9291 3.0884 3.0884 3.3832 3.3832 3.8488 3.8488 4.4244 4.4244 4.7876 4.7876 4.9520 4.9520 5.1146 5.1146 5.1562 5.1562 5.5683 5.5683 10.8091 10.8091 11.2876 11.2876 11.4363 11.4363 11.9172 11.9172 12.1956 12.1956 k = 0.0889-0.2119-0.3876 ( 4225 PWs) bands (ev): -34.2337 -34.2337 -34.1876 -34.1876 -15.4512 -15.4512 -15.2062 -15.2062 -14.2266 -14.2266 -13.9120 -13.9120 -13.7814 -13.7814 -13.7037 -13.7037 -10.0748 -10.0748 -9.9846 -9.9846 -7.4152 -7.4152 -7.3486 -7.3486 2.7239 2.7239 2.7629 2.7629 2.9464 2.9464 3.0903 3.0903 3.4134 3.4134 3.8375 3.8375 4.4612 4.4612 4.7335 4.7335 4.9353 4.9353 5.0961 5.0961 5.1367 5.1367 5.5616 5.5616 10.8111 10.8111 11.2983 11.2983 11.4661 11.4661 11.9359 11.9359 12.2652 12.2652 k = 0.0948-0.2261-0.4135 ( 4223 PWs) bands (ev): -34.2323 -34.2323 -34.1870 -34.1870 -15.4563 -15.4563 -15.2158 -15.2158 -14.2351 -14.2351 -13.9284 -13.9284 -13.7905 -13.7905 -13.7052 -13.7052 -10.0489 -10.0489 -9.9569 -9.9569 -7.4140 -7.4140 -7.3463 -7.3463 2.7212 2.7212 2.7557 2.7557 2.9641 2.9641 3.0938 3.0938 3.4450 3.4450 3.8228 3.8228 4.4943 4.4943 4.6808 4.6808 4.9212 4.9212 5.0770 5.0770 5.1163 5.1163 5.5541 5.5541 10.8109 10.8109 11.3107 11.3107 11.4993 11.4993 11.9546 11.9546 12.3379 12.3379 k = 0.1008-0.2402-0.4393 ( 4215 PWs) bands (ev): -34.2310 -34.2310 -34.1863 -34.1863 -15.4618 -15.4618 -15.2259 -15.2259 -14.2439 -14.2439 -13.9450 -13.9450 -13.7994 -13.7994 -13.7069 -13.7069 -10.0225 -10.0225 -9.9286 -9.9286 -7.4125 -7.4125 -7.3437 -7.3437 2.7193 2.7193 2.7495 2.7495 2.9818 2.9818 3.0990 3.0990 3.4778 3.4778 3.8051 3.8051 4.5174 4.5174 4.6360 4.6360 4.9098 4.9098 5.0574 5.0574 5.0952 5.0952 5.5460 5.5460 10.8086 10.8086 11.3248 11.3248 11.5355 11.5355 11.9734 11.9734 12.4103 12.4103 k = 0.1067-0.2543-0.4652 ( 4213 PWs) bands (ev): -34.2295 -34.2295 -34.1857 -34.1857 -15.4676 -15.4676 -15.2364 -15.2364 -14.2532 -14.2532 -13.9616 -13.9616 -13.8081 -13.8081 -13.7087 -13.7087 -9.9957 -9.9957 -9.8999 -9.8999 -7.4108 -7.4108 -7.3409 -7.3409 2.7181 2.7181 2.7443 2.7443 2.9995 2.9995 3.1058 3.1058 3.5115 3.5115 3.7848 3.7848 4.5104 4.5104 4.6194 4.6194 4.9009 4.9009 5.0370 5.0370 5.0737 5.0737 5.5372 5.5372 10.8043 10.8043 11.3404 11.3404 11.5742 11.5742 11.9926 11.9926 12.4673 12.4673 k = 0.1126-0.2685-0.4910 ( 4216 PWs) bands (ev): -34.2281 -34.2281 -34.1850 -34.1850 -15.4737 -15.4737 -15.2472 -15.2472 -14.2629 -14.2629 -13.9781 -13.9781 -13.8165 -13.8165 -13.7108 -13.7108 -9.9686 -9.9686 -9.8710 -9.8710 -7.4087 -7.4087 -7.3377 -7.3377 2.7176 2.7176 2.7403 2.7403 3.0167 3.0167 3.1143 3.1143 3.5455 3.5455 3.7628 3.7628 4.4692 4.4692 4.6349 4.6349 4.8940 4.8940 5.0158 5.0158 5.0526 5.0526 5.5276 5.5276 10.7982 10.7982 11.3575 11.3575 11.6148 11.6148 12.0123 12.0123 12.5108 12.5108 k = 0.1186-0.2826-0.5168 ( 4210 PWs) bands (ev): -34.2265 -34.2265 -34.1843 -34.1843 -15.4802 -15.4802 -15.2584 -15.2584 -14.2730 -14.2730 -13.9943 -13.9943 -13.8245 -13.8245 -13.7130 -13.7130 -9.9414 -9.9414 -9.8418 -9.8418 -7.4063 -7.4063 -7.3343 -7.3343 2.7177 2.7177 2.7376 2.7376 3.0333 3.0333 3.1246 3.1246 3.5786 3.5786 3.7407 3.7407 4.4162 4.4162 4.6602 4.6602 4.8885 4.8885 4.9939 4.9939 5.0324 5.0324 5.5174 5.5174 10.7902 10.7902 11.3759 11.3759 11.6569 11.6569 12.0326 12.0326 12.5509 12.5509 k = 0.1245-0.2967-0.5427 ( 4208 PWs) bands (ev): -34.2250 -34.2250 -34.1836 -34.1836 -15.4871 -15.4871 -15.2697 -15.2697 -14.2834 -14.2834 -14.0101 -14.0101 -13.8321 -13.8321 -13.7154 -13.7154 -9.9142 -9.9142 -9.8126 -9.8126 -7.4036 -7.4036 -7.3305 -7.3305 2.7185 2.7185 2.7362 2.7362 3.0490 3.0490 3.1366 3.1366 3.6074 3.6074 3.7223 3.7223 4.3602 4.3602 4.6863 4.6863 4.8835 4.8835 4.9718 4.9718 5.0138 5.0138 5.5064 5.5064 10.7804 10.7804 11.3954 11.3954 11.6998 11.6998 12.0537 12.0537 12.5884 12.5884 k = 0.1304-0.3109-0.5685 ( 4208 PWs) bands (ev): -34.2234 -34.2234 -34.1829 -34.1829 -15.4942 -15.4942 -15.2812 -15.2812 -14.2942 -14.2942 -14.0254 -14.0254 -13.8394 -13.8394 -13.7180 -13.7180 -9.8872 -9.8872 -9.7835 -9.7835 -7.4005 -7.4005 -7.3265 -7.3265 2.7198 2.7198 2.7360 2.7360 3.0637 3.0637 3.1502 3.1502 3.6227 3.6227 3.7174 3.7174 4.3036 4.3036 4.7105 4.7105 4.8775 4.8775 4.9506 4.9506 4.9973 4.9973 5.4948 5.4948 10.7687 10.7687 11.4159 11.4159 11.7428 11.7428 12.0756 12.0756 12.6236 12.6236 k = 0.1363-0.3250-0.5944 ( 4200 PWs) bands (ev): -34.2217 -34.2217 -34.1822 -34.1822 -15.5017 -15.5017 -15.2928 -15.2928 -14.3054 -14.3054 -14.0401 -14.0401 -13.8464 -13.8464 -13.7209 -13.7209 -9.8604 -9.8604 -9.7546 -9.7546 -7.3970 -7.3970 -7.3222 -7.3222 2.7215 2.7215 2.7370 2.7370 3.0776 3.0776 3.1653 3.1653 3.6161 3.6161 3.7348 3.7348 4.2475 4.2475 4.7315 4.7315 4.8678 4.8678 4.9330 4.9330 4.9833 4.9833 5.4824 5.4824 10.7548 10.7548 11.4371 11.4371 11.7853 11.7853 12.0983 12.0983 12.6561 12.6561 k = 0.1423-0.3391-0.6202 ( 4200 PWs) bands (ev): -34.2201 -34.2201 -34.1816 -34.1816 -15.5095 -15.5095 -15.3043 -15.3043 -14.3171 -14.3171 -14.0540 -14.0540 -13.8530 -13.8530 -13.7239 -13.7239 -9.8340 -9.8340 -9.7259 -9.7259 -7.3931 -7.3931 -7.3176 -7.3176 2.7234 2.7234 2.7391 2.7391 3.0907 3.0907 3.1813 3.1813 3.5968 3.5968 3.7658 3.7658 4.1924 4.1924 4.7482 4.7482 4.8518 4.8518 4.9218 4.9218 4.9721 4.9721 5.4692 5.4692 10.7387 10.7387 11.4588 11.4588 11.8269 11.8269 12.1220 12.1220 12.6857 12.6857 k = 0.1482-0.3532-0.6460 ( 4200 PWs) bands (ev): -34.2184 -34.2184 -34.1809 -34.1809 -15.5176 -15.5176 -15.3157 -15.3157 -14.3291 -14.3291 -14.0670 -14.0670 -13.8593 -13.8593 -13.7271 -13.7271 -9.8080 -9.8080 -9.6976 -9.6976 -7.3889 -7.3889 -7.3128 -7.3128 2.7251 2.7251 2.7425 2.7425 3.1032 3.1032 3.1981 3.1981 3.5738 3.5738 3.8019 3.8019 4.1388 4.1388 4.7594 4.7594 4.8300 4.8300 4.9171 4.9171 4.9640 4.9640 5.4553 5.4553 10.7200 10.7200 11.4808 11.4808 11.8668 11.8668 12.1465 12.1465 12.7125 12.7125 k = 0.1541-0.3674-0.6719 ( 4206 PWs) bands (ev): -34.2167 -34.2167 -34.1802 -34.1802 -15.5260 -15.5260 -15.3269 -15.3269 -14.3416 -14.3416 -14.0791 -14.0791 -13.8653 -13.8653 -13.7306 -13.7306 -9.7826 -9.7826 -9.6698 -9.6698 -7.3844 -7.3844 -7.3077 -7.3077 2.7262 2.7262 2.7472 2.7472 3.1152 3.1152 3.2153 3.2153 3.5509 3.5509 3.8397 3.8397 4.0869 4.0869 4.7646 4.7646 4.8050 4.8050 4.9170 4.9170 4.9588 4.9588 5.4406 5.4406 10.6985 10.6985 11.5027 11.5027 11.9048 11.9048 12.1720 12.1720 12.7361 12.7361 k = 0.1601-0.3815-0.6977 ( 4206 PWs) bands (ev): -34.2150 -34.2150 -34.1796 -34.1796 -15.5346 -15.5346 -15.3377 -15.3377 -14.3545 -14.3545 -14.0903 -14.0903 -13.8711 -13.8711 -13.7342 -13.7342 -9.7577 -9.7577 -9.6424 -9.6424 -7.3794 -7.3794 -7.3025 -7.3025 2.7262 2.7262 2.7532 2.7532 3.1269 3.1269 3.2326 3.2326 3.5295 3.5295 3.8780 3.8780 4.0371 4.0371 4.7623 4.7623 4.7802 4.7802 4.9197 4.9197 4.9561 4.9561 5.4253 5.4253 10.6740 10.6740 11.5243 11.5243 11.9405 11.9405 12.1984 12.1984 12.7567 12.7567 k = 0.1660-0.3956-0.7236 ( 4210 PWs) bands (ev): -34.2133 -34.2133 -34.1790 -34.1790 -15.5435 -15.5435 -15.3482 -15.3482 -14.3678 -14.3678 -14.1003 -14.1003 -13.8766 -13.8766 -13.7381 -13.7381 -9.7335 -9.7335 -9.6156 -9.6156 -7.3742 -7.3742 -7.2971 -7.2971 2.7250 2.7250 2.7604 2.7604 3.1383 3.1383 3.2498 3.2498 3.5107 3.5107 3.9158 3.9158 3.9899 3.9899 4.7448 4.7448 4.7654 4.7654 4.9236 4.9236 4.9555 4.9555 5.4093 5.4093 10.6462 10.6462 11.5452 11.5452 11.9739 11.9739 12.2257 12.2257 12.7741 12.7741 k = 0.1719-0.4098-0.7494 ( 4214 PWs) bands (ev): -34.2116 -34.2116 -34.1784 -34.1784 -15.5527 -15.5527 -15.3582 -15.3582 -14.3815 -14.3815 -14.1093 -14.1093 -13.8819 -13.8819 -13.7421 -13.7421 -9.7100 -9.7100 -9.5894 -9.5894 -7.3686 -7.3686 -7.2916 -7.2916 2.7224 2.7224 2.7686 2.7686 3.1492 3.1492 3.2670 3.2670 3.4952 3.4952 3.9401 3.9401 3.9580 3.9580 4.7184 4.7184 4.7563 4.7563 4.9271 4.9271 4.9566 4.9566 5.3928 5.3928 10.6150 10.6150 11.5650 11.5650 12.0051 12.0051 12.2537 12.2537 12.7885 12.7885 k = 0.1778-0.4239-0.7753 ( 4220 PWs) bands (ev): -34.2099 -34.2099 -34.1778 -34.1778 -15.5620 -15.5620 -15.3677 -15.3677 -14.3956 -14.3956 -14.1171 -14.1171 -13.8870 -13.8870 -13.7463 -13.7463 -9.6873 -9.6873 -9.5639 -9.5639 -7.3628 -7.3628 -7.2860 -7.2860 2.7182 2.7182 2.7776 2.7776 3.1595 3.1595 3.2842 3.2842 3.4834 3.4834 3.9009 3.9009 3.9910 3.9910 4.6913 4.6913 4.7462 4.7462 4.9292 4.9292 4.9588 4.9588 5.3757 5.3757 10.5805 10.5805 11.5835 11.5835 12.0345 12.0345 12.2826 12.2826 12.8000 12.8000 k = 0.1838-0.4380-0.8011 ( 4224 PWs) bands (ev): -34.2082 -34.2082 -34.1772 -34.1772 -15.5714 -15.5714 -15.3766 -15.3766 -14.4101 -14.4101 -14.1239 -14.1239 -13.8919 -13.8919 -13.7507 -13.7507 -9.6654 -9.6654 -9.5391 -9.5391 -7.3567 -7.3567 -7.2804 -7.2804 2.7126 2.7126 2.7872 2.7872 3.1691 3.1691 3.3014 3.3014 3.4754 3.4754 3.8616 3.8616 4.0254 4.0254 4.6647 4.6647 4.7354 4.7354 4.9297 4.9297 4.9614 4.9614 5.3582 5.3582 10.5425 10.5425 11.6002 11.6002 12.0627 12.0627 12.3122 12.3122 12.8090 12.8090 k = 0.1897-0.4521-0.8269 ( 4220 PWs) bands (ev): -34.2065 -34.2065 -34.1767 -34.1767 -15.5809 -15.5809 -15.3847 -15.3847 -14.4248 -14.4248 -14.1296 -14.1296 -13.8968 -13.8968 -13.7552 -13.7552 -9.6443 -9.6443 -9.5150 -9.5150 -7.3503 -7.3503 -7.2747 -7.2747 2.7054 2.7054 2.7972 2.7972 3.1776 3.1776 3.3191 3.3191 3.4715 3.4715 3.8251 3.8251 4.0579 4.0579 4.6393 4.6393 4.7241 4.7241 4.9287 4.9287 4.9636 4.9636 5.3404 5.3404 10.5013 10.5013 11.6149 11.6149 12.0903 12.0903 12.3425 12.3425 12.8156 12.8156 k = 0.1956-0.4663-0.8528 ( 4220 PWs) bands (ev): -34.2048 -34.2048 -34.1763 -34.1763 -15.5905 -15.5905 -15.3922 -15.3922 -14.4398 -14.4398 -14.1343 -14.1343 -13.9015 -13.9015 -13.7598 -13.7598 -9.6240 -9.6240 -9.4917 -9.4917 -7.3438 -7.3438 -7.2692 -7.2692 2.6969 2.6969 2.8075 2.8075 3.1848 3.1848 3.3374 3.3374 3.4715 3.4715 3.7915 3.7915 4.0877 4.0877 4.6154 4.6154 4.7127 4.7127 4.9265 4.9265 4.9645 4.9645 5.3223 5.3223 10.4571 10.4571 11.6270 11.6270 12.1181 12.1181 12.3733 12.3733 12.8203 12.8203 k = 0.2016-0.4804-0.8786 ( 4220 PWs) bands (ev): -34.2032 -34.2032 -34.1758 -34.1758 -15.6001 -15.6001 -15.3990 -15.3990 -14.4549 -14.4549 -14.1380 -14.1380 -13.9062 -13.9062 -13.7646 -13.7646 -9.6046 -9.6046 -9.4692 -9.4692 -7.3372 -7.3372 -7.2637 -7.2637 2.6874 2.6874 2.8177 2.8177 3.1906 3.1906 3.3567 3.3567 3.4752 3.4752 3.7609 3.7609 4.1143 4.1143 4.5933 4.5933 4.7017 4.7017 4.9232 4.9232 4.9639 4.9639 5.3042 5.3042 10.4104 10.4104 11.6362 11.6362 12.1465 12.1465 12.4046 12.4046 12.8235 12.8235 k = 0.2075-0.4945-0.9045 ( 4226 PWs) bands (ev): -34.2015 -34.2015 -34.1754 -34.1754 -15.6096 -15.6096 -15.4050 -15.4050 -14.4702 -14.4702 -14.1408 -14.1408 -13.9109 -13.9109 -13.7694 -13.7694 -9.5861 -9.5861 -9.4475 -9.4475 -7.3305 -7.3305 -7.2583 -7.2583 2.6771 2.6771 2.8276 2.8276 3.1947 3.1947 3.3773 3.3773 3.4822 3.4822 3.7331 3.7331 4.1373 4.1373 4.5733 4.5733 4.6912 4.6912 4.9194 4.9194 4.9614 4.9614 5.2860 5.2860 10.3616 10.3616 11.6424 11.6424 12.1761 12.1761 12.4363 12.4363 12.8256 12.8256 k = 0.2134-0.5087-0.9303 ( 4224 PWs) bands (ev): -34.2000 -34.2000 -34.1751 -34.1751 -15.6190 -15.6190 -15.4102 -15.4102 -14.4855 -14.4855 -14.1427 -14.1427 -13.9155 -13.9155 -13.7743 -13.7743 -9.5685 -9.5685 -9.4266 -9.4266 -7.3237 -7.3237 -7.2532 -7.2532 2.6665 2.6665 2.8371 2.8371 3.1974 3.1974 3.3994 3.3994 3.4920 3.4920 3.7079 3.7079 4.1562 4.1562 4.5555 4.5555 4.6814 4.6814 4.9151 4.9151 4.9568 4.9568 5.2679 5.2679 10.3112 10.3112 11.6453 11.6453 12.2074 12.2074 12.4684 12.4684 12.8272 12.8272 k = 0.2193-0.5228-0.9561 ( 4220 PWs) bands (ev): -34.1984 -34.1984 -34.1748 -34.1748 -15.6282 -15.6282 -15.4146 -15.4146 -14.5008 -14.5008 -14.1437 -14.1437 -13.9202 -13.9202 -13.7792 -13.7792 -9.5518 -9.5518 -9.4066 -9.4066 -7.3170 -7.3170 -7.2482 -7.2482 2.6560 2.6560 2.8459 2.8459 3.1989 3.1989 3.4231 3.4231 3.5041 3.5041 3.6853 3.6853 4.1710 4.1710 4.5397 4.5397 4.6723 4.6723 4.9109 4.9109 4.9501 4.9501 5.2500 5.2500 10.2598 10.2598 11.6448 11.6448 12.2406 12.2406 12.5007 12.5007 12.8288 12.8288 k = 0.2253-0.5369-0.9820 ( 4220 PWs) bands (ev): -34.1969 -34.1969 -34.1745 -34.1745 -15.6371 -15.6371 -15.4183 -15.4183 -14.5161 -14.5161 -14.1440 -14.1440 -13.9250 -13.9250 -13.7841 -13.7841 -9.5359 -9.5359 -9.3874 -9.3874 -7.3103 -7.3103 -7.2435 -7.2435 2.6458 2.6458 2.8538 2.8538 3.1995 3.1995 3.4484 3.4484 3.5177 3.5177 3.6650 3.6650 4.1817 4.1817 4.5255 4.5255 4.6642 4.6642 4.9073 4.9073 4.9413 4.9413 5.2322 5.2322 10.2078 10.2078 11.6408 11.6408 12.2757 12.2757 12.5331 12.5331 12.8311 12.8311 k = 0.2312-0.5511-1.0078 ( 4220 PWs) bands (ev): -34.1954 -34.1954 -34.1743 -34.1743 -15.6458 -15.6458 -15.4212 -15.4212 -14.5311 -14.5311 -14.1435 -14.1435 -13.9299 -13.9299 -13.7890 -13.7890 -9.5210 -9.5210 -9.3691 -9.3691 -7.3037 -7.3037 -7.2391 -7.2391 2.6363 2.6363 2.8606 2.8606 3.1997 3.1997 3.4750 3.4750 3.5321 3.5321 3.6469 3.6469 4.1888 4.1888 4.5122 4.5122 4.6569 4.6569 4.9046 4.9046 4.9304 4.9304 5.2147 5.2147 10.1560 10.1560 11.6336 11.6336 12.3128 12.3128 12.5657 12.5657 12.8344 12.8344 k = 0.2371-0.5652-1.0337 ( 4216 PWs) bands (ev): -34.1940 -34.1940 -34.1741 -34.1741 -15.6541 -15.6541 -15.4234 -15.4234 -14.5460 -14.5460 -14.1423 -14.1423 -13.9349 -13.9349 -13.7938 -13.7938 -9.5069 -9.5069 -9.3516 -9.3516 -7.2973 -7.2973 -7.2351 -7.2351 2.6279 2.6279 2.8661 2.8661 3.1999 3.1999 3.5024 3.5024 3.5462 3.5462 3.6316 3.6316 4.1933 4.1933 4.4989 4.4989 4.6507 4.6507 4.9032 4.9032 4.9176 4.9176 5.1974 5.1974 10.1048 10.1048 11.6233 11.6233 12.3517 12.3517 12.5982 12.5982 12.8391 12.8391 k = 0.2430-0.5793-1.0595 ( 4222 PWs) bands (ev): -34.1926 -34.1926 -34.1740 -34.1740 -15.6621 -15.6621 -15.4249 -15.4249 -14.5606 -14.5606 -14.1405 -14.1405 -13.9401 -13.9401 -13.7984 -13.7984 -9.4937 -9.4937 -9.3351 -9.3351 -7.2910 -7.2910 -7.2314 -7.2314 2.6209 2.6209 2.8701 2.8701 3.2008 3.2008 3.5295 3.5295 3.5580 3.5580 3.6210 3.6210 4.1961 4.1961 4.4847 4.4847 4.6454 4.6454 4.9005 4.9005 4.9058 4.9058 5.1804 5.1804 10.0547 10.0547 11.6103 11.6103 12.3921 12.3921 12.6307 12.6307 12.8454 12.8454 k = 0.2490-0.5934-1.0854 ( 4222 PWs) bands (ev): -34.1912 -34.1912 -34.1739 -34.1739 -15.6696 -15.6696 -15.4258 -15.4258 -14.5749 -14.5749 -14.1380 -14.1380 -13.9454 -13.9454 -13.8030 -13.8030 -9.4814 -9.4814 -9.3194 -9.3194 -7.2850 -7.2850 -7.2281 -7.2281 2.6155 2.6155 2.8726 2.8726 3.2026 3.2026 3.5513 3.5513 3.5660 3.5660 3.6205 3.6205 4.1984 4.1984 4.4687 4.4687 4.6411 4.6411 4.8848 4.8848 4.9069 4.9069 5.1637 5.1637 10.0063 10.0063 11.5950 11.5950 12.4339 12.4339 12.6630 12.6630 12.8535 12.8535 k = 0.2549-0.6076-1.1112 ( 4228 PWs) bands (ev): -34.1899 -34.1899 -34.1739 -34.1739 -15.6767 -15.6767 -15.4260 -15.4260 -14.5887 -14.5887 -14.1350 -14.1350 -13.9510 -13.9510 -13.8073 -13.8073 -9.4700 -9.4700 -9.3047 -9.3047 -7.2793 -7.2793 -7.2252 -7.2252 2.6118 2.6118 2.8734 2.8734 3.2057 3.2057 3.5517 3.5517 3.5807 3.5807 3.6346 3.6346 4.2013 4.2013 4.4504 4.4504 4.6379 4.6379 4.8662 4.8662 4.9109 4.9109 5.1473 5.1473 9.9598 9.9598 11.5779 11.5779 12.4764 12.4764 12.6952 12.6952 12.8634 12.8634 k = 0.2608-0.6217-1.1370 ( 4232 PWs) bands (ev): -34.1887 -34.1887 -34.1739 -34.1739 -15.6832 -15.6832 -15.4257 -15.4257 -14.6021 -14.6021 -14.1314 -14.1314 -13.9568 -13.9568 -13.8114 -13.8114 -9.4595 -9.4595 -9.2908 -9.2908 -7.2738 -7.2738 -7.2226 -7.2226 2.6101 2.6101 2.8725 2.8725 3.2104 3.2104 3.5407 3.5407 3.5944 3.5944 3.6601 3.6601 4.2056 4.2056 4.4297 4.4297 4.6357 4.6357 4.8458 4.8458 4.9163 4.9163 5.1312 5.1312 9.9158 9.9158 11.5594 11.5594 12.5194 12.5194 12.7270 12.7270 12.8751 12.8751 k = 0.2668-0.6358-1.1629 ( 4234 PWs) bands (ev): -34.1875 -34.1875 -34.1740 -34.1740 -15.6893 -15.6893 -15.4249 -15.4249 -14.6149 -14.6149 -14.1273 -14.1273 -13.9628 -13.9628 -13.8153 -13.8153 -9.4498 -9.4498 -9.2780 -9.2780 -7.2687 -7.2687 -7.2205 -7.2205 2.6106 2.6106 2.8699 2.8699 3.2169 3.2169 3.5266 3.5266 3.6035 3.6035 3.6914 3.6914 4.2121 4.2121 4.4065 4.4065 4.6347 4.6347 4.8240 4.8240 4.9227 4.9227 5.1156 5.1156 9.8745 9.8745 11.5402 11.5402 12.5621 12.5621 12.7585 12.7585 12.8886 12.8886 k = 0.2727-0.6500-1.1887 ( 4236 PWs) bands (ev): -34.1864 -34.1864 -34.1742 -34.1742 -15.6948 -15.6948 -15.4237 -15.4237 -14.6270 -14.6270 -14.1227 -14.1227 -13.9691 -13.9691 -13.8189 -13.8189 -9.4410 -9.4410 -9.2661 -9.2661 -7.2639 -7.2639 -7.2188 -7.2188 2.6132 2.6132 2.8656 2.8656 3.2252 3.2252 3.5112 3.5112 3.6085 3.6085 3.7257 3.7257 4.2211 4.2211 4.3813 4.3813 4.6346 4.6346 4.8010 4.8010 4.9293 4.9293 5.1007 5.1007 9.8361 9.8361 11.5208 11.5208 12.6040 12.6040 12.7896 12.7896 12.9036 12.9036 k = 0.2786-0.6641-1.2146 ( 4238 PWs) bands (ev): -34.1853 -34.1853 -34.1743 -34.1743 -15.6998 -15.6998 -15.4221 -15.4221 -14.6384 -14.6384 -14.1175 -14.1175 -13.9757 -13.9757 -13.8222 -13.8222 -9.4330 -9.4330 -9.2552 -9.2552 -7.2596 -7.2596 -7.2174 -7.2174 2.6181 2.6181 2.8596 2.8596 3.2352 3.2352 3.4954 3.4954 3.6098 3.6098 3.7615 3.7615 4.2323 4.2323 4.3548 4.3548 4.6354 4.6354 4.7773 4.7773 4.9353 4.9353 5.0869 5.0869 9.8009 9.8009 11.5015 11.5015 12.6444 12.6444 12.8202 12.8202 12.9201 12.9201 k = 0.2845-0.6782-1.2404 ( 4224 PWs) bands (ev): -34.1843 -34.1843 -34.1746 -34.1746 -15.7043 -15.7043 -15.4203 -15.4203 -14.6490 -14.6490 -14.1120 -14.1120 -13.9826 -13.9826 -13.8252 -13.8252 -9.4259 -9.4259 -9.2454 -9.2454 -7.2556 -7.2556 -7.2164 -7.2164 2.6254 2.6254 2.8520 2.8520 3.2470 3.2470 3.4795 3.4795 3.6076 3.6076 3.7980 3.7980 4.2441 4.2441 4.3289 4.3289 4.6365 4.6365 4.7534 4.7534 4.9398 4.9398 5.0745 5.0745 9.7691 9.7691 11.4830 11.4830 12.6823 12.6823 12.8501 12.8501 12.9381 12.9381 k = 0.2905-0.6923-1.2662 ( 4226 PWs) bands (ev): -34.1833 -34.1833 -34.1748 -34.1748 -15.7082 -15.7082 -15.4183 -15.4183 -14.6587 -14.6587 -14.1060 -14.1060 -13.9896 -13.9896 -13.8279 -13.8279 -9.4196 -9.4196 -9.2366 -9.2366 -7.2520 -7.2520 -7.2157 -7.2157 2.6349 2.6349 2.8426 2.8426 3.2604 3.2604 3.4638 3.4638 3.6023 3.6023 3.8349 3.8349 4.2501 4.2501 4.3104 4.3104 4.6370 4.6370 4.7307 4.7307 4.9420 4.9420 5.0643 5.0643 9.7409 9.7409 11.4656 11.4656 12.7167 12.7167 12.8792 12.8792 12.9575 12.9575 k = 0.2964-0.7065-1.2921 ( 4230 PWs) bands (ev): -34.1824 -34.1824 -34.1751 -34.1751 -15.7116 -15.7116 -15.4162 -15.4162 -14.6675 -14.6675 -14.0996 -14.0996 -13.9970 -13.9970 -13.8302 -13.8302 -9.4142 -9.4142 -9.2289 -9.2289 -7.2488 -7.2488 -7.2154 -7.2154 2.6469 2.6469 2.8315 2.8315 3.2753 3.2753 3.4487 3.4487 3.5942 3.5942 3.8717 3.8717 4.2370 4.2370 4.3120 4.3120 4.6343 4.6343 4.7120 4.7120 4.9408 4.9408 5.0569 5.0569 9.7162 9.7162 11.4496 11.4496 12.7467 12.7467 12.9071 12.9071 12.9783 12.9783 k = 0.3023-0.7206-1.3179 ( 4234 PWs) bands (ev): -34.1815 -34.1815 -34.1755 -34.1755 -15.7144 -15.7144 -15.4142 -15.4142 -14.6751 -14.6751 -14.0929 -14.0929 -14.0045 -14.0045 -13.8322 -13.8322 -9.4096 -9.4096 -9.2222 -9.2222 -7.2460 -7.2460 -7.2153 -7.2153 2.6611 2.6611 2.8186 2.8186 3.2911 3.2911 3.4348 3.4348 3.5837 3.5837 3.9082 3.9082 4.2099 4.2099 4.3290 4.3290 4.6244 4.6244 4.7015 4.7015 4.9358 4.9358 5.0525 5.0525 9.6952 9.6952 11.4354 11.4354 12.7713 12.7713 12.9333 12.9333 13.0008 13.0008 k = 0.3083-0.7347-1.3438 ( 4242 PWs) bands (ev): -34.1807 -34.1807 -34.1759 -34.1759 -15.7167 -15.7167 -15.4122 -15.4122 -14.6816 -14.6816 -14.0859 -14.0859 -14.0121 -14.0121 -13.8338 -13.8338 -9.4058 -9.4058 -9.2167 -9.2167 -7.2437 -7.2437 -7.2154 -7.2154 2.6777 2.6777 2.8039 2.8039 3.3073 3.3073 3.4229 3.4229 3.5713 3.5713 3.9440 3.9440 4.1782 4.1782 4.3515 4.3515 4.6058 4.6058 4.7007 4.7007 4.9274 4.9274 5.0508 5.0508 9.6780 9.6780 11.4232 11.4232 12.7897 12.7897 12.9575 12.9575 13.0247 13.0247 k = 0.3142-0.7489-1.3696 ( 4246 PWs) bands (ev): -34.1800 -34.1800 -34.1763 -34.1763 -15.7185 -15.7185 -15.4106 -15.4106 -14.6869 -14.6869 -14.0787 -14.0787 -14.0199 -14.0199 -13.8351 -13.8351 -9.4029 -9.4029 -9.2124 -9.2124 -7.2418 -7.2418 -7.2157 -7.2157 2.6963 2.6963 2.7873 2.7873 3.3225 3.3225 3.4146 3.4146 3.5573 3.5573 3.9790 3.9790 4.1450 4.1450 4.3763 4.3763 4.5818 4.5818 4.7068 4.7068 4.9162 4.9162 5.0511 5.0511 9.6645 9.6645 11.4134 11.4134 12.8017 12.8017 12.9795 12.9795 13.0492 13.0492 k = 0.3201-0.7630-1.3955 ( 4250 PWs) bands (ev): -34.1793 -34.1793 -34.1768 -34.1768 -15.7198 -15.7198 -15.4092 -15.4092 -14.6908 -14.6908 -14.0714 -14.0714 -14.0275 -14.0275 -13.8361 -13.8361 -9.4008 -9.4008 -9.2092 -9.2092 -7.2403 -7.2403 -7.2160 -7.2160 2.7170 2.7170 2.7688 2.7688 3.3340 3.3340 3.4126 3.4126 3.5422 3.5422 4.0127 4.0127 4.1114 4.1114 4.4020 4.4020 4.5552 4.5552 4.7172 4.7172 4.9031 4.9031 5.0525 5.0525 9.6548 9.6548 11.4060 11.4060 12.8073 12.8073 12.9989 12.9989 13.0710 13.0710 k = 0.3260-0.7771-1.4213 ( 4250 PWs) bands (ev): -34.1787 -34.1787 -34.1773 -34.1773 -15.7206 -15.7206 -15.4083 -15.4083 -14.6933 -14.6933 -14.0648 -14.0648 -14.0343 -14.0343 -13.8367 -13.8367 -9.3995 -9.3995 -9.2071 -9.2071 -7.2392 -7.2392 -7.2164 -7.2164 2.7383 2.7383 2.7498 2.7498 3.3391 3.3391 3.4197 3.4197 3.5262 3.5262 4.0441 4.0441 4.0788 4.0788 4.4275 4.4275 4.5278 4.5278 4.7304 4.7304 4.8890 4.8890 5.0543 5.0543 9.6489 9.6489 11.4013 11.4013 12.8071 12.8071 13.0158 13.0158 13.0823 13.0823 k = 0.3320-0.7913-1.4471 ( 4248 PWs) bands (ev): -34.1781 -34.1781 -34.1778 -34.1778 -15.7209 -15.7209 -15.4078 -15.4078 -14.6944 -14.6944 -14.0606 -14.0606 -14.0386 -14.0386 -13.8369 -13.8369 -9.3989 -9.3989 -9.2063 -9.2063 -7.2385 -7.2385 -7.2169 -7.2169 2.7249 2.7249 2.7653 2.7653 3.3383 3.3383 3.4353 3.4353 3.5097 3.5097 4.0419 4.0419 4.0786 4.0786 4.4508 4.4508 4.5019 4.5019 4.7456 4.7456 4.8744 4.8744 5.0561 5.0561 9.6466 9.6466 11.3992 11.3992 12.8020 12.8020 13.0296 13.0296 13.0806 13.0806 k = 0.3379-0.8054-1.4730 ( 4242 PWs) bands (ev): -34.1784 -34.1784 -34.1776 -34.1776 -15.7208 -15.7208 -15.4080 -15.4080 -14.6940 -14.6940 -14.0624 -14.0624 -14.0367 -14.0367 -13.8368 -13.8368 -9.3991 -9.3991 -9.2066 -9.2066 -7.2382 -7.2382 -7.2172 -7.2172 2.7008 2.7008 2.7912 2.7912 3.3347 3.3347 3.4557 3.4557 3.4939 3.4939 4.0102 4.0102 4.1070 4.1070 4.4579 4.4579 4.4915 4.4915 4.7624 4.7624 4.8600 4.8600 5.0576 5.0576 9.6481 9.6481 11.4000 11.4000 12.7927 12.7927 13.0360 13.0360 13.0726 13.0726 k = 0.6621-0.7047-1.4133 ( 4242 PWs) bands (ev): -34.1784 -34.1784 -34.1776 -34.1776 -15.7208 -15.7208 -15.4080 -15.4080 -14.6940 -14.6940 -14.0624 -14.0624 -14.0367 -14.0367 -13.8368 -13.8368 -9.3991 -9.3991 -9.2066 -9.2066 -7.2382 -7.2382 -7.2172 -7.2172 2.7008 2.7008 2.7912 2.7912 3.3347 3.3347 3.4557 3.4557 3.4939 3.4939 4.0102 4.0102 4.1070 4.1070 4.4579 4.4579 4.4915 4.4915 4.7624 4.7624 4.8600 4.8600 5.0576 5.0576 9.6481 9.6481 11.4000 11.4000 12.7927 12.7927 13.0360 13.0360 13.0726 13.0726 k = 0.6561-0.6749-1.4133 ( 4244 PWs) bands (ev): -34.1790 -34.1790 -34.1771 -34.1771 -15.7202 -15.7202 -15.4088 -15.4088 -14.6920 -14.6920 -14.0689 -14.0689 -14.0301 -14.0301 -13.8364 -13.8364 -9.4001 -9.4001 -9.2081 -9.2081 -7.2382 -7.2382 -7.2176 -7.2176 2.6745 2.6745 2.8192 2.8192 3.3305 3.3305 3.4682 3.4682 3.4891 3.4891 3.9782 3.9782 4.1348 4.1348 4.4361 4.4361 4.5091 4.5091 4.7799 4.7799 4.8467 4.8467 5.0586 5.0586 9.6532 9.6532 11.4036 11.4036 12.7797 12.7797 13.0235 13.0235 13.0728 13.0728 k = 0.6501-0.6451-1.4133 ( 4240 PWs) bands (ev): -34.1796 -34.1796 -34.1766 -34.1766 -15.7192 -15.7192 -15.4104 -15.4104 -14.6885 -14.6885 -14.0770 -14.0770 -14.0218 -14.0218 -13.8356 -13.8356 -9.4017 -9.4017 -9.2108 -9.2108 -7.2385 -7.2385 -7.2178 -7.2178 2.6465 2.6465 2.8483 2.8483 3.3268 3.3268 3.4550 3.4550 3.5120 3.5120 3.9472 3.9472 4.1609 4.1609 4.4097 4.4097 4.5303 4.5303 4.7950 4.7950 4.8378 4.8378 5.0591 5.0591 9.6620 9.6620 11.4101 11.4101 12.7635 12.7635 12.9955 12.9955 13.0812 13.0812 k = 0.6441-0.6153-1.4133 ( 4234 PWs) bands (ev): -34.1802 -34.1802 -34.1762 -34.1762 -15.7178 -15.7178 -15.4126 -15.4126 -14.6835 -14.6835 -14.0858 -14.0858 -14.0128 -14.0128 -13.8344 -13.8344 -9.4041 -9.4041 -9.2147 -9.2147 -7.2390 -7.2390 -7.2180 -7.2180 2.6171 2.6171 2.8783 2.8783 3.3241 3.3241 3.4387 3.4387 3.5396 3.5396 3.9177 3.9177 4.1850 4.1850 4.3835 4.3835 4.5501 4.5501 4.7992 4.7992 4.8419 4.8419 5.0591 5.0591 9.6744 9.6744 11.4195 11.4195 12.7445 12.7445 12.9608 12.9608 13.0909 13.0909 k = 0.6381-0.5854-1.4133 ( 4234 PWs) bands (ev): -34.1808 -34.1808 -34.1759 -34.1759 -15.7161 -15.7161 -15.4157 -15.4157 -14.6771 -14.6771 -14.0948 -14.0948 -14.0034 -14.0034 -13.8329 -13.8329 -9.4070 -9.4070 -9.2198 -9.2198 -7.2397 -7.2397 -7.2181 -7.2181 2.5867 2.5867 2.9087 2.9087 3.3227 3.3227 3.4226 3.4226 3.5683 3.5683 3.8900 3.8900 4.2071 4.2071 4.3584 4.3584 4.5675 4.5675 4.7923 4.7923 4.8591 4.8591 5.0585 5.0585 9.6902 9.6902 11.4316 11.4316 12.7231 12.7231 12.9226 12.9226 13.1004 13.1004 k = 0.6321-0.5556-1.4133 ( 4230 PWs) bands (ev): -34.1815 -34.1815 -34.1755 -34.1755 -15.7140 -15.7140 -15.4194 -15.4194 -14.6692 -14.6692 -14.1041 -14.1041 -13.9939 -13.9939 -13.8311 -13.8311 -9.4105 -9.4105 -9.2259 -9.2259 -7.2404 -7.2404 -7.2182 -7.2182 2.5554 2.5554 2.9391 2.9391 3.3227 3.3227 3.4072 3.4072 3.5971 3.5971 3.8642 3.8642 4.2272 4.2272 4.3350 4.3350 4.5820 4.5820 4.7829 4.7829 4.8809 4.8809 5.0575 5.0575 9.7094 9.7094 11.4463 11.4463 12.6993 12.6993 12.8823 12.8823 13.1092 13.1092 k = 0.6261-0.5258-1.4133 ( 4228 PWs) bands (ev): -34.1821 -34.1821 -34.1753 -34.1753 -15.7115 -15.7115 -15.4239 -15.4239 -14.6600 -14.6600 -14.1134 -14.1134 -13.9843 -13.9843 -13.8288 -13.8288 -9.4145 -9.4145 -9.2331 -9.2331 -7.2412 -7.2412 -7.2182 -7.2182 2.5235 2.5235 2.9689 2.9689 3.3240 3.3240 3.3928 3.3928 3.6255 3.6255 3.8408 3.8408 4.2450 4.2450 4.3139 4.3139 4.5932 4.5932 4.7740 4.7740 4.9043 4.9043 5.0561 5.0561 9.7319 9.7319 11.4635 11.4635 12.6733 12.6733 12.8406 12.8406 13.1172 13.1172 k = 0.6201-0.4959-1.4133 ( 4228 PWs) bands (ev): -34.1828 -34.1828 -34.1750 -34.1750 -15.7088 -15.7088 -15.4290 -15.4290 -14.6496 -14.6496 -14.1229 -14.1229 -13.9748 -13.9748 -13.8263 -13.8263 -9.4189 -9.4189 -9.2413 -9.2413 -7.2420 -7.2420 -7.2181 -7.2181 2.4913 2.4913 2.9975 2.9975 3.3267 3.3267 3.3798 3.3798 3.6529 3.6529 3.8199 3.8199 4.2596 4.2596 4.2967 4.2967 4.6008 4.6008 4.7665 4.7665 4.9284 4.9284 5.0542 5.0542 9.7575 9.7575 11.4830 11.4830 12.6449 12.6449 12.7984 12.7984 13.1243 13.1243 k = 0.6141-0.4661-1.4133 ( 4226 PWs) bands (ev): -34.1834 -34.1834 -34.1748 -34.1748 -15.7057 -15.7057 -15.4348 -15.4348 -14.6381 -14.6381 -14.1325 -14.1325 -13.9653 -13.9653 -13.8234 -13.8234 -9.4237 -9.4237 -9.2505 -9.2505 -7.2427 -7.2427 -7.2180 -7.2180 2.4591 2.4591 3.0240 3.0240 3.3308 3.3308 3.3686 3.3686 3.6785 3.6785 3.8021 3.8021 4.2649 4.2649 4.2901 4.2901 4.6051 4.6051 4.7605 4.7605 4.9525 4.9525 5.0521 5.0521 9.7861 9.7861 11.5046 11.5046 12.6139 12.6139 12.7564 12.7564 13.1305 13.1305 k = 0.6081-0.4363-1.4133 ( 4230 PWs) bands (ev): -34.1841 -34.1841 -34.1746 -34.1746 -15.7023 -15.7023 -15.4411 -15.4411 -14.6256 -14.6256 -14.1421 -14.1421 -13.9560 -13.9560 -13.8201 -13.8201 -9.4288 -9.4288 -9.2604 -9.2604 -7.2433 -7.2433 -7.2179 -7.2179 2.4271 2.4271 3.0477 3.0477 3.3361 3.3361 3.3594 3.3594 3.7016 3.7016 3.7876 3.7876 4.2576 4.2576 4.2978 4.2978 4.6063 4.6063 4.7558 4.7558 4.9764 4.9764 5.0496 5.0496 9.8174 9.8174 11.5279 11.5279 12.5802 12.5802 12.7153 12.7153 13.1357 13.1357 k = 0.6021-0.4065-1.4133 ( 4228 PWs) bands (ev): -34.1847 -34.1847 -34.1745 -34.1745 -15.6987 -15.6987 -15.4480 -15.4480 -14.6122 -14.6122 -14.1518 -14.1518 -13.9470 -13.9470 -13.8166 -13.8166 -9.4340 -9.4340 -9.2711 -9.2711 -7.2439 -7.2439 -7.2177 -7.2177 2.3957 2.3957 3.0678 3.0678 3.3427 3.3427 3.3526 3.3526 3.7214 3.7214 3.7770 3.7770 4.2495 4.2495 4.3089 4.3089 4.6051 4.6051 4.7519 4.7519 4.9997 4.9997 5.0468 5.0468 9.8514 9.8514 11.5527 11.5527 12.5435 12.5435 12.6757 12.6757 13.1397 13.1397 k = 0.5961-0.3766-1.4133 ( 4226 PWs) bands (ev): -34.1853 -34.1853 -34.1744 -34.1744 -15.6948 -15.6948 -15.4552 -15.4552 -14.5982 -14.5982 -14.1615 -14.1615 -13.9382 -13.9382 -13.8127 -13.8127 -9.4393 -9.4393 -9.2825 -9.2825 -7.2443 -7.2443 -7.2175 -7.2175 2.3649 2.3649 3.0837 3.0837 3.3475 3.3475 3.3511 3.3511 3.7371 3.7371 3.7706 3.7706 4.2448 4.2448 4.3196 4.3196 4.6021 4.6021 4.7484 4.7484 5.0218 5.0218 5.0440 5.0440 9.8877 9.8877 11.5787 11.5787 12.5037 12.5037 12.6384 12.6384 13.1423 13.1423 k = 0.5901-0.3468-1.4133 ( 4226 PWs) bands (ev): -34.1859 -34.1859 -34.1742 -34.1742 -15.6907 -15.6907 -15.4629 -15.4629 -14.5835 -14.5835 -14.1713 -14.1713 -13.9298 -13.9298 -13.8086 -13.8086 -9.4447 -9.4447 -9.2943 -9.2943 -7.2446 -7.2446 -7.2172 -7.2172 2.3350 2.3350 3.0950 3.0950 3.3454 3.3454 3.3597 3.3597 3.7482 3.7482 3.7690 3.7690 4.2440 4.2440 4.3298 4.3298 4.5982 4.5982 4.7448 4.7448 5.0361 5.0361 5.0476 5.0476 9.9261 9.9261 11.6053 11.6053 12.4609 12.4609 12.6034 12.6034 13.1432 13.1432 k = 0.5841-0.3170-1.4133 ( 4220 PWs) bands (ev): -34.1865 -34.1865 -34.1742 -34.1742 -15.6863 -15.6863 -15.4708 -15.4708 -14.5684 -14.5684 -14.1812 -14.1812 -13.9218 -13.9218 -13.8042 -13.8042 -9.4499 -9.4499 -9.3067 -9.3067 -7.2449 -7.2449 -7.2169 -7.2169 2.3063 2.3063 3.1021 3.1021 3.3447 3.3447 3.3695 3.3695 3.7546 3.7546 3.7720 3.7720 4.2474 4.2474 4.3393 4.3393 4.5939 4.5939 4.7408 4.7408 5.0336 5.0336 5.0663 5.0663 9.9663 9.9663 11.6323 11.6323 12.4157 12.4157 12.5708 12.5708 13.1425 13.1425 k = 0.5780-0.2871-1.4133 ( 4226 PWs) bands (ev): -34.1871 -34.1871 -34.1741 -34.1741 -15.6817 -15.6817 -15.4790 -15.4790 -14.5530 -14.5530 -14.1911 -14.1911 -13.9143 -13.9143 -13.7997 -13.7997 -9.4548 -9.4548 -9.3193 -9.3193 -7.2450 -7.2450 -7.2166 -7.2166 2.2789 2.2789 3.1054 3.1054 3.3450 3.3450 3.3802 3.3802 3.7570 3.7570 3.7791 3.7791 4.2544 4.2544 4.3485 4.3485 4.5896 4.5896 4.7363 4.7363 5.0286 5.0286 5.0854 5.0854 10.0080 10.0080 11.6592 11.6592 12.3687 12.3687 12.5405 12.5405 13.1402 13.1402 k = 0.5720-0.2573-1.4133 ( 4234 PWs) bands (ev): -34.1876 -34.1876 -34.1741 -34.1741 -15.6769 -15.6769 -15.4873 -15.4873 -14.5373 -14.5373 -14.2011 -14.2011 -13.9072 -13.9072 -13.7951 -13.7951 -9.4595 -9.4595 -9.3321 -9.3321 -7.2450 -7.2450 -7.2163 -7.2163 2.2529 2.2529 3.1057 3.1057 3.3455 3.3455 3.3916 3.3916 3.7553 3.7553 3.7901 3.7901 4.2641 4.2641 4.3577 4.3577 4.5857 4.5857 4.7312 4.7312 5.0227 5.0227 5.1033 5.1033 10.0508 10.0508 11.6856 11.6856 12.3204 12.3204 12.5124 12.5124 13.1368 13.1368 k = 0.5660-0.2275-1.4133 ( 4236 PWs) bands (ev): -34.1881 -34.1881 -34.1740 -34.1740 -15.6719 -15.6719 -15.4958 -15.4958 -14.5216 -14.5216 -14.2111 -14.2111 -13.9006 -13.9006 -13.7904 -13.7904 -9.4637 -9.4637 -9.3450 -9.3450 -7.2450 -7.2450 -7.2159 -7.2159 2.2285 2.2285 3.1039 3.1039 3.3458 3.3458 3.4036 3.4036 3.7498 3.7498 3.8049 3.8049 4.2753 4.2753 4.3674 4.3674 4.5825 4.5825 4.7257 4.7257 5.0159 5.0159 5.1198 5.1198 10.0942 10.0942 11.7110 11.7110 12.2717 12.2717 12.4862 12.4862 13.1329 13.1329 k = 0.5600-0.1977-1.4133 ( 4232 PWs) bands (ev): -34.1886 -34.1886 -34.1740 -34.1740 -15.6667 -15.6667 -15.5043 -15.5043 -14.5060 -14.5060 -14.2212 -14.2212 -13.8945 -13.8945 -13.7858 -13.7858 -9.4674 -9.4674 -9.3578 -9.3578 -7.2449 -7.2449 -7.2155 -7.2155 2.2059 2.2059 3.1006 3.1006 3.3455 3.3455 3.4163 3.4163 3.7411 3.7411 3.8227 3.8227 4.2868 4.2868 4.3780 4.3780 4.5800 4.5800 4.7198 4.7198 5.0084 5.0084 5.1348 5.1348 10.1377 10.1377 11.7351 11.7351 12.2232 12.2232 12.4620 12.4620 13.1294 13.1294 k = 0.5540-0.1678-1.4133 ( 4234 PWs) bands (ev): -34.1890 -34.1890 -34.1740 -34.1740 -15.6613 -15.6613 -15.5127 -15.5127 -14.4905 -14.4905 -14.2313 -14.2313 -13.8890 -13.8890 -13.7813 -13.7813 -9.4705 -9.4705 -9.3705 -9.3705 -7.2447 -7.2447 -7.2151 -7.2151 2.1851 2.1851 3.0966 3.0966 3.3446 3.3446 3.4295 3.4295 3.7299 3.7299 3.8424 3.8424 4.2973 4.2973 4.3899 4.3899 4.5785 4.5785 4.7136 4.7136 5.0001 5.0001 5.1482 5.1482 10.1808 10.1808 11.7575 11.7575 12.1755 12.1755 12.4398 12.4398 13.1270 13.1271 k = 0.5480-0.1380-1.4133 ( 4238 PWs) bands (ev): -34.1894 -34.1894 -34.1740 -34.1740 -15.6558 -15.6558 -15.5211 -15.5211 -14.4752 -14.4752 -14.2415 -14.2415 -13.8840 -13.8840 -13.7770 -13.7770 -9.4729 -9.4729 -9.3828 -9.3828 -7.2445 -7.2445 -7.2147 -7.2147 2.1662 2.1662 3.0921 3.0921 3.3432 3.3432 3.4433 3.4433 3.7168 3.7168 3.8631 3.8631 4.3061 4.3061 4.4031 4.4031 4.5778 4.5778 4.7075 4.7075 4.9912 4.9912 5.1600 5.1600 10.2228 10.2228 11.7778 11.7778 12.1293 12.1293 12.4197 12.4197 13.1264 13.1265 k = 0.5420-0.1082-1.4133 ( 4240 PWs) bands (ev): -34.1898 -34.1898 -34.1740 -34.1740 -15.6502 -15.6502 -15.5293 -15.5293 -14.4604 -14.4604 -14.2516 -14.2516 -13.8796 -13.8796 -13.7730 -13.7730 -9.4745 -9.4745 -9.3947 -9.3947 -7.2443 -7.2443 -7.2143 -7.2143 2.1493 2.1493 3.0876 3.0876 3.3414 3.3414 3.4576 3.4576 3.7023 3.7023 3.8839 3.8839 4.3130 4.3130 4.4172 4.4172 4.5779 4.5779 4.7015 4.7015 4.9821 4.9821 5.1703 5.1703 10.2629 10.2629 11.7960 11.7960 12.0855 12.0855 12.4017 12.4017 13.1278 13.1279 k = 0.5360-0.0783-1.4133 ( 4232 PWs) bands (ev): -34.1901 -34.1901 -34.1740 -34.1740 -15.6446 -15.6446 -15.5373 -15.5373 -14.4461 -14.4461 -14.2617 -14.2617 -13.8758 -13.8758 -13.7693 -13.7693 -9.4752 -9.4752 -9.4061 -9.4061 -7.2440 -7.2440 -7.2140 -7.2140 2.1346 2.1346 3.0834 3.0834 3.3394 3.3394 3.4724 3.4724 3.6868 3.6868 3.9037 3.9037 4.3181 4.3181 4.4314 4.4314 4.5787 4.5787 4.6959 4.6959 4.9728 4.9728 5.1790 5.1790 10.3004 10.3004 11.8117 11.8117 12.0448 12.0448 12.3859 12.3859 13.1313 13.1313 k = 0.5300-0.0485-1.4133 ( 4236 PWs) bands (ev): -34.1903 -34.1903 -34.1740 -34.1740 -15.6390 -15.6390 -15.5449 -15.5449 -14.4325 -14.4325 -14.2716 -14.2716 -13.8725 -13.8725 -13.7661 -13.7661 -9.4750 -9.4750 -9.4168 -9.4168 -7.2438 -7.2438 -7.2137 -7.2137 2.1220 2.1220 3.0795 3.0795 3.3374 3.3374 3.4875 3.4875 3.6707 3.6707 3.9219 3.9219 4.3217 4.3217 4.4451 4.4451 4.5800 4.5800 4.6909 4.6909 4.9639 4.9639 5.1862 5.1862 10.3344 10.3344 11.8249 11.8249 12.0082 12.0082 12.3724 12.3724 13.1367 13.1367 k = 0.5240-0.0187-1.4133 ( 4234 PWs) bands (ev): -34.1905 -34.1905 -34.1740 -34.1740 -15.6336 -15.6336 -15.5521 -15.5521 -14.4200 -14.4200 -14.2811 -14.2811 -13.8698 -13.8698 -13.7634 -13.7634 -9.4739 -9.4739 -9.4268 -9.4268 -7.2436 -7.2436 -7.2134 -7.2134 2.1117 2.1117 3.0762 3.0762 3.3356 3.3356 3.5028 3.5028 3.6544 3.6544 3.9377 3.9377 4.3242 4.3242 4.4574 4.4574 4.5815 4.5815 4.6865 4.6865 4.9558 4.9558 5.1920 5.1920 10.3640 10.3640 11.8356 11.8356 11.9766 11.9766 12.3613 12.3613 13.1437 13.1437 k = 0.5180 0.0112-1.4133 ( 4226 PWs) bands (ev): -34.1907 -34.1907 -34.1740 -34.1740 -15.6286 -15.6286 -15.5584 -15.5584 -14.4088 -14.4088 -14.2898 -14.2898 -13.8677 -13.8677 -13.7612 -13.7612 -9.4717 -9.4717 -9.4359 -9.4359 -7.2435 -7.2435 -7.2132 -7.2132 2.1036 2.1036 3.0736 3.0736 3.3341 3.3341 3.5180 3.5180 3.6384 3.6384 3.9506 3.9506 4.3259 4.3259 4.4678 4.4678 4.5829 4.5829 4.6830 4.6830 4.9488 4.9488 5.1964 5.1964 10.3882 10.3882 11.8437 11.8437 11.9510 11.9510 12.3526 12.3526 13.1517 13.1517 k = 0.5120 0.0410-1.4133 ( 4224 PWs) bands (ev): -34.1908 -34.1908 -34.1740 -34.1740 -15.6243 -15.6243 -15.5636 -15.5636 -14.3996 -14.3996 -14.2972 -14.2972 -13.8662 -13.8662 -13.7597 -13.7597 -9.4687 -9.4687 -9.4441 -9.4441 -7.2434 -7.2434 -7.2130 -7.2130 2.0977 2.0977 3.0716 3.0716 3.3329 3.3329 3.5322 3.5322 3.6234 3.6234 3.9602 3.9602 4.3269 4.3269 4.4756 4.4756 4.5841 4.5841 4.6804 4.6804 4.9434 4.9434 5.1995 5.1995 10.4062 10.4062 11.8493 11.8493 11.9321 11.9321 12.3463 12.3463 13.1599 13.1599 k = 0.5060 0.0708-1.4133 ( 4222 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6214 -15.6214 -15.5671 -15.5671 -14.3934 -14.3934 -14.3023 -14.3023 -13.8653 -13.8653 -13.7587 -13.7587 -9.4649 -9.4649 -9.4510 -9.4510 -7.2433 -7.2433 -7.2129 -7.2129 2.0943 2.0943 3.0704 3.0704 3.3321 3.3321 3.5439 3.5439 3.6113 3.6113 3.9660 3.9660 4.3275 4.3275 4.4805 4.4805 4.5849 4.5849 4.6788 4.6788 4.9400 4.9400 5.2014 5.2014 10.4173 10.4173 11.8525 11.8525 11.9206 11.9206 12.3425 12.3425 13.1670 13.1670 k = 0.5000 0.1006-1.4133 ( 4214 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6203 -15.6203 -15.5684 -15.5684 -14.3912 -14.3912 -14.3042 -14.3042 -13.8649 -13.8649 -13.7584 -13.7584 -9.4621 -9.4621 -9.4547 -9.4547 -7.2433 -7.2433 -7.2129 -7.2129 2.0931 2.0931 3.0701 3.0701 3.3319 3.3319 3.5489 3.5489 3.6061 3.6061 3.9680 3.9680 4.3276 4.3276 4.4822 4.4822 4.5852 4.5852 4.6783 4.6783 4.9389 4.9389 5.2020 5.2020 10.4211 10.4211 11.8535 11.8535 11.9167 11.9167 12.3413 12.3413 13.1701 13.1701 k = 0.5000 0.1006-1.4133 ( 4214 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6203 -15.6203 -15.5684 -15.5684 -14.3912 -14.3912 -14.3042 -14.3042 -13.8649 -13.8649 -13.7584 -13.7584 -9.4621 -9.4621 -9.4547 -9.4547 -7.2433 -7.2433 -7.2129 -7.2129 2.0931 2.0931 3.0701 3.0701 3.3319 3.3319 3.5489 3.5489 3.6061 3.6061 3.9680 3.9680 4.3276 4.3276 4.4822 4.4822 4.5852 4.5852 4.6783 4.6783 4.9389 4.9389 5.2020 5.2020 10.4211 10.4211 11.8535 11.8535 11.9167 11.9167 12.3413 12.3413 13.1701 13.1701 k = 0.5270 0.1061-1.4034 ( 4224 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6203 -15.6203 -15.5684 -15.5684 -14.3912 -14.3912 -14.3041 -14.3041 -13.8650 -13.8650 -13.7584 -13.7584 -9.4622 -9.4622 -9.4547 -9.4547 -7.2435 -7.2435 -7.2127 -7.2127 2.0937 2.0937 3.0693 3.0693 3.3303 3.3303 3.5490 3.5490 3.6062 3.6062 3.9683 3.9683 4.3306 4.3306 4.4816 4.4816 4.5855 4.5855 4.6786 4.6786 4.9370 4.9370 5.2022 5.2022 10.4214 10.4214 11.8524 11.8524 11.9168 11.9168 12.3423 12.3423 13.1686 13.1686 k = 0.5540 0.1115-1.3934 ( 4218 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6203 -15.6203 -15.5683 -15.5683 -14.3912 -14.3912 -14.3041 -14.3041 -13.8650 -13.8650 -13.7584 -13.7584 -9.4625 -9.4625 -9.4546 -9.4546 -7.2440 -7.2440 -7.2123 -7.2123 2.0955 2.0955 3.0670 3.0670 3.3256 3.3256 3.5493 3.5493 3.6065 3.6065 3.9693 3.9693 4.3392 4.3392 4.4801 4.4801 4.5862 4.5862 4.6796 4.6796 4.9316 4.9316 5.2026 5.2026 10.4224 10.4224 11.8492 11.8492 11.9169 11.9169 12.3453 12.3453 13.1633 13.1633 k = 0.5811 0.1170-1.3835 ( 4220 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6202 -15.6202 -15.5681 -15.5681 -14.3912 -14.3912 -14.3039 -14.3039 -13.8650 -13.8650 -13.7583 -13.7583 -9.4629 -9.4629 -9.4544 -9.4544 -7.2450 -7.2450 -7.2116 -7.2116 2.0985 2.0985 3.0630 3.0630 3.3186 3.3186 3.5492 3.5492 3.6069 3.6069 3.9714 3.9714 4.3527 4.3527 4.4779 4.4779 4.5873 4.5873 4.6812 4.6812 4.9230 4.9230 5.2032 5.2032 10.4240 10.4240 11.8440 11.8440 11.9172 11.9172 12.3501 12.3501 13.1531 13.1531 k = 0.6081 0.1224-1.3735 ( 4221 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6202 -15.6202 -15.5679 -15.5679 -14.3912 -14.3912 -14.3038 -14.3038 -13.8650 -13.8650 -13.7583 -13.7583 -9.4634 -9.4634 -9.4542 -9.4542 -7.2462 -7.2462 -7.2107 -7.2107 2.1026 2.1026 3.0575 3.0575 3.3103 3.3103 3.5480 3.5480 3.6073 3.6073 3.9752 3.9752 4.3699 4.3699 4.4754 4.4754 4.5884 4.5884 4.6834 4.6834 4.9118 4.9118 5.2034 5.2034 10.4261 10.4261 11.8371 11.8371 11.9176 11.9176 12.3564 12.3564 13.1385 13.1385 k = 0.6351 0.1278-1.3636 ( 4221 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6201 -15.6201 -15.5676 -15.5676 -14.3911 -14.3911 -14.3036 -14.3036 -13.8650 -13.8650 -13.7582 -13.7582 -9.4640 -9.4640 -9.4539 -9.4539 -7.2476 -7.2476 -7.2097 -7.2097 2.1077 2.1077 3.0502 3.0502 3.3014 3.3014 3.5453 3.5453 3.6078 3.6078 3.9810 3.9810 4.3893 4.3893 4.4735 4.4735 4.5894 4.5894 4.6862 4.6862 4.8988 4.8988 5.2030 5.2030 10.4288 10.4288 11.8287 11.8287 11.9181 11.9181 12.3638 12.3638 13.1217 13.1217 k = 0.6621 0.1333-1.3536 ( 4222 PWs) bands (ev): -34.1911 -34.1911 -34.1740 -34.1740 -15.6200 -15.6200 -15.5672 -15.5672 -14.3911 -14.3911 -14.3033 -14.3033 -13.8651 -13.8651 -13.7582 -13.7582 -9.4647 -9.4647 -9.4537 -9.4537 -7.2491 -7.2491 -7.2086 -7.2086 2.1137 2.1137 3.0414 3.0414 3.2930 3.2930 3.5408 3.5408 3.6082 3.6082 3.9891 3.9891 4.4085 4.4085 4.4738 4.4738 4.5901 4.5901 4.6896 4.6896 4.8847 4.8847 5.2016 5.2016 10.4320 10.4320 11.8191 11.8191 11.9188 11.9188 12.3720 12.3720 13.1042 13.1042 k = 0.6621 0.1333-1.3536 ( 4222 PWs) bands (ev): -34.1911 -34.1911 -34.1740 -34.1740 -15.6200 -15.6200 -15.5672 -15.5672 -14.3911 -14.3911 -14.3033 -14.3033 -13.8651 -13.8651 -13.7582 -13.7582 -9.4647 -9.4647 -9.4537 -9.4537 -7.2491 -7.2491 -7.2086 -7.2086 2.1137 2.1137 3.0414 3.0414 3.2930 3.2930 3.5408 3.5408 3.6082 3.6082 3.9891 3.9891 4.4085 4.4085 4.4738 4.4738 4.5901 4.5901 4.6896 4.6896 4.8847 4.8847 5.2016 5.2016 10.4320 10.4320 11.8191 11.8191 11.9188 11.9188 12.3720 12.3720 13.1042 13.1042 k = 0.6587 0.1326-1.3236 ( 4224 PWs) bands (ev): -34.1913 -34.1913 -34.1740 -34.1740 -15.6195 -15.6195 -15.5648 -15.5648 -14.3909 -14.3909 -14.3016 -14.3016 -13.8653 -13.8653 -13.7577 -13.7577 -9.4691 -9.4691 -9.4531 -9.4531 -7.2510 -7.2510 -7.2094 -7.2094 2.1211 2.1211 3.0416 3.0416 3.2798 3.2798 3.5391 3.5391 3.6054 3.6054 3.9979 3.9979 4.4144 4.4144 4.4682 4.4682 4.5825 4.5825 4.7032 4.7032 4.8707 4.8707 5.2121 5.2121 10.4376 10.4376 11.8201 11.8201 11.9152 11.9152 12.3758 12.3758 13.1111 13.1111 k = 0.6552 0.1319-1.2935 ( 4219 PWs) bands (ev): -34.1918 -34.1918 -34.1740 -34.1740 -15.6186 -15.6186 -15.5610 -15.5610 -14.3906 -14.3906 -14.2988 -14.2988 -13.8657 -13.8657 -13.7569 -13.7569 -9.4748 -9.4748 -9.4533 -9.4533 -7.2539 -7.2539 -7.2106 -7.2106 2.1313 2.1313 3.0438 3.0438 3.2637 3.2637 3.5354 3.5354 3.6006 3.6006 4.0024 4.0024 4.4242 4.4242 4.4621 4.4621 4.5765 4.5765 4.7183 4.7183 4.8565 4.8565 5.2236 5.2236 10.4460 10.4460 11.8210 11.8210 11.9102 11.9102 12.3812 12.3812 13.1131 13.1131 k = 0.6518 0.1312-1.2634 ( 4223 PWs) bands (ev): -34.1923 -34.1923 -34.1740 -34.1740 -15.6173 -15.6173 -15.5561 -15.5561 -14.3902 -14.3902 -14.2952 -14.2952 -13.8661 -13.8661 -13.7559 -13.7559 -9.4816 -9.4816 -9.4545 -9.4545 -7.2577 -7.2577 -7.2122 -7.2122 2.1442 2.1442 3.0481 3.0481 3.2452 3.2452 3.5300 3.5300 3.5940 3.5940 4.0030 4.0030 4.4290 4.4290 4.4626 4.4626 4.5737 4.5737 4.7340 4.7340 4.8422 4.8422 5.2359 5.2359 10.4569 10.4569 11.8216 11.8216 11.9038 11.9038 12.3881 12.3881 13.1095 13.1095 k = 0.6483 0.1305-1.2334 ( 4224 PWs) bands (ev): -34.1930 -34.1930 -34.1741 -34.1741 -15.6156 -15.6156 -15.5501 -15.5501 -14.3896 -14.3896 -14.2907 -14.2907 -13.8667 -13.8667 -13.7547 -13.7547 -9.4894 -9.4894 -9.4568 -9.4568 -7.2625 -7.2625 -7.2143 -7.2143 2.1596 2.1596 3.0541 3.0541 3.2250 3.2250 3.5229 3.5229 3.5856 3.5856 4.0005 4.0005 4.4192 4.4192 4.4768 4.4768 4.5760 4.5760 4.7498 4.7498 4.8282 4.8282 5.2489 5.2489 10.4701 10.4701 11.8219 11.8219 11.8960 11.8960 12.3964 12.3964 13.1001 13.1001 k = 0.6449 0.1298-1.2033 ( 4220 PWs) bands (ev): -34.1938 -34.1938 -34.1741 -34.1741 -15.6134 -15.6134 -15.5431 -15.5431 -14.3887 -14.3887 -14.2853 -14.2853 -13.8673 -13.8673 -13.7533 -13.7533 -9.4983 -9.4983 -9.4602 -9.4602 -7.2681 -7.2681 -7.2167 -7.2167 2.1774 2.1774 3.0614 3.0614 3.2036 3.2036 3.5144 3.5144 3.5753 3.5753 3.9961 3.9961 4.4013 4.4013 4.4956 4.4956 4.5851 4.5851 4.7645 4.7645 4.8152 4.8152 5.2624 5.2624 10.4853 10.4853 11.8217 11.8217 11.8870 11.8870 12.4062 12.4062 13.0855 13.0855 k = 0.6414 0.1291-1.1732 ( 4218 PWs) bands (ev): -34.1947 -34.1947 -34.1742 -34.1742 -15.6106 -15.6106 -15.5350 -15.5350 -14.3875 -14.3875 -14.2791 -14.2791 -13.8678 -13.8678 -13.7516 -13.7516 -9.5083 -9.5083 -9.4647 -9.4647 -7.2744 -7.2744 -7.2195 -7.2195 2.1975 2.1975 3.0694 3.0694 3.1820 3.1820 3.5048 3.5048 3.5633 3.5633 3.9907 3.9907 4.3790 4.3790 4.5127 4.5127 4.6026 4.6026 4.7739 4.7739 4.8075 4.8075 5.2764 5.2764 10.5023 10.5023 11.8208 11.8208 11.8769 11.8769 12.4172 12.4172 13.0667 13.0667 k = 0.6380 0.1284-1.1431 ( 4221 PWs) bands (ev): -34.1957 -34.1957 -34.1744 -34.1744 -15.6074 -15.6074 -15.5261 -15.5261 -14.3861 -14.3861 -14.2722 -14.2722 -13.8684 -13.8684 -13.7499 -13.7499 -9.5192 -9.5192 -9.4705 -9.4705 -7.2815 -7.2815 -7.2226 -7.2226 2.2195 2.2195 3.0764 3.0764 3.1618 3.1618 3.4944 3.4944 3.5497 3.5497 3.9851 3.9851 4.3534 4.3534 4.5266 4.5266 4.6279 4.6279 4.7696 4.7696 4.8133 4.8133 5.2905 5.2905 10.5206 10.5206 11.8191 11.8191 11.8657 11.8657 12.4294 12.4294 13.0448 13.0448 k = 0.6345 0.1277-1.1131 ( 4221 PWs) bands (ev): -34.1968 -34.1968 -34.1745 -34.1745 -15.6037 -15.6037 -15.5164 -15.5164 -14.3843 -14.3843 -14.2644 -14.2644 -13.8689 -13.8689 -13.7480 -13.7480 -9.5312 -9.5312 -9.4774 -9.4774 -7.2892 -7.2892 -7.2261 -7.2261 2.2432 2.2432 3.0791 3.0791 3.1468 3.1468 3.4833 3.4833 3.5346 3.5346 3.9802 3.9802 4.3252 4.3252 4.5385 4.5385 4.6582 4.6582 4.7572 4.7572 4.8273 4.8273 5.3047 5.3047 10.5399 10.5399 11.8164 11.8164 11.8535 11.8535 12.4423 12.4423 13.0207 13.0207 k = 0.6311 0.1270-1.0830 ( 4225 PWs) bands (ev): -34.1980 -34.1980 -34.1747 -34.1747 -15.5995 -15.5995 -15.5059 -15.5059 -14.3821 -14.3821 -14.2560 -14.2560 -13.8693 -13.8693 -13.7460 -13.7460 -9.5442 -9.5442 -9.4857 -9.4857 -7.2974 -7.2974 -7.2297 -7.2297 2.2682 2.2682 3.0724 3.0724 3.1420 3.1420 3.4721 3.4721 3.5182 3.5182 3.9766 3.9766 4.2947 4.2947 4.5496 4.5496 4.6897 4.6897 4.7440 4.7440 4.8437 4.8437 5.3188 5.3188 10.5599 10.5599 11.8124 11.8124 11.8404 11.8404 12.4558 12.4558 12.9948 12.9948 k = 0.6276 0.1263-1.0529 ( 4224 PWs) bands (ev): -34.1993 -34.1993 -34.1750 -34.1750 -15.5947 -15.5947 -15.4948 -15.4948 -14.3796 -14.3796 -14.2468 -14.2468 -13.8696 -13.8696 -13.7439 -13.7439 -9.5582 -9.5582 -9.4952 -9.4952 -7.3061 -7.3061 -7.2336 -7.2336 2.2943 2.2943 3.0566 3.0566 3.1470 3.1470 3.4611 3.4611 3.5007 3.5007 3.9749 3.9749 4.2623 4.2623 4.5609 4.5609 4.7080 4.7080 4.7445 4.7445 4.8608 4.8608 5.3325 5.3325 10.5800 10.5800 11.8069 11.8069 11.8266 11.8266 12.4696 12.4696 12.9676 12.9676 k = 0.6242 0.1256-1.0229 ( 4228 PWs) bands (ev): -34.2007 -34.2007 -34.1752 -34.1752 -15.5896 -15.5896 -15.4830 -15.4830 -14.3766 -14.3766 -14.2369 -14.2369 -13.8697 -13.8697 -13.7417 -13.7417 -9.5733 -9.5733 -9.5060 -9.5060 -7.3152 -7.3152 -7.2376 -7.2376 2.3208 2.3208 3.0368 3.0368 3.1567 3.1567 3.4502 3.4502 3.4828 3.4828 3.9755 3.9755 4.2281 4.2281 4.5727 4.5727 4.6977 4.6977 4.7731 4.7731 4.8783 4.8783 5.3459 5.3459 10.6000 10.6000 11.7998 11.7998 11.8120 11.8120 12.4832 12.4832 12.9393 12.9393 k = 0.6207 0.1249-0.9928 ( 4224 PWs) bands (ev): -34.2021 -34.2021 -34.1756 -34.1756 -15.5840 -15.5840 -15.4706 -15.4706 -14.3732 -14.3732 -14.2263 -14.2263 -13.8696 -13.8696 -13.7395 -13.7395 -9.5893 -9.5893 -9.5182 -9.5182 -7.3245 -7.3245 -7.2417 -7.2417 2.3474 2.3474 3.0163 3.0163 3.1678 3.1678 3.4387 3.4387 3.4660 3.4660 3.9789 3.9789 4.1924 4.1924 4.5849 4.5849 4.6805 4.6805 4.8079 4.8079 4.8962 4.8962 5.3588 5.3588 10.6195 10.6195 11.7909 11.7909 11.7968 11.7968 12.4962 12.4962 12.9100 12.9100 k = 0.6173 0.1242-0.9627 ( 4221 PWs) bands (ev): -34.2035 -34.2035 -34.1759 -34.1759 -15.5780 -15.5780 -15.4578 -15.4578 -14.3693 -14.3693 -14.2151 -14.2151 -13.8692 -13.8692 -13.7373 -13.7373 -9.6064 -9.6064 -9.5316 -9.5316 -7.3341 -7.3341 -7.2459 -7.2459 2.3734 2.3734 2.9965 2.9965 3.1787 3.1787 3.4242 3.4242 3.4538 3.4538 3.9854 3.9854 4.1555 4.1555 4.5968 4.5968 4.6624 4.6624 4.8430 4.8430 4.9144 4.9144 5.3710 5.3710 10.6382 10.6382 11.7796 11.7796 11.7816 11.7816 12.5082 12.5082 12.8799 12.8799 k = 0.6138 0.1235-0.9326 ( 4222 PWs) bands (ev): -34.2051 -34.2051 -34.1763 -34.1763 -15.5717 -15.5717 -15.4445 -15.4445 -14.3649 -14.3649 -14.2033 -14.2033 -13.8686 -13.8686 -13.7351 -13.7351 -9.6246 -9.6246 -9.5464 -9.5464 -7.3439 -7.3439 -7.2500 -7.2500 2.3983 2.3983 2.9781 2.9781 3.1881 3.1881 3.4052 3.4052 3.4484 3.4484 3.9952 3.9952 4.1176 4.1176 4.6052 4.6052 4.6474 4.6474 4.8769 4.8769 4.9332 4.9332 5.3825 5.3825 10.6557 10.6557 11.7641 11.7641 11.7682 11.7682 12.5187 12.5187 12.8490 12.8490 k = 0.6104 0.1229-0.9026 ( 4220 PWs) bands (ev): -34.2066 -34.2066 -34.1768 -34.1768 -15.5651 -15.5651 -15.4309 -15.4309 -14.3601 -14.3601 -14.1908 -14.1908 -13.8676 -13.8676 -13.7329 -13.7329 -9.6437 -9.6437 -9.5625 -9.5625 -7.3537 -7.3537 -7.2541 -7.2541 2.4214 2.4214 2.9619 2.9619 3.1954 3.1954 3.3833 3.3833 3.4493 3.4493 4.0081 4.0081 4.0792 4.0792 4.6000 4.6000 4.6458 4.6458 4.9090 4.9090 4.9527 4.9527 5.3933 5.3933 10.6718 10.6718 11.7471 11.7471 11.7538 11.7538 12.5274 12.5274 12.8176 12.8176 k = 0.6069 0.1222-0.8725 ( 4219 PWs) bands (ev): -34.2082 -34.2082 -34.1773 -34.1773 -15.5583 -15.5583 -15.4170 -15.4170 -14.3547 -14.3547 -14.1777 -14.1777 -13.8663 -13.8663 -13.7307 -13.7307 -9.6638 -9.6638 -9.5799 -9.5799 -7.3635 -7.3635 -7.2580 -7.2580 2.4422 2.4422 2.9481 2.9481 3.2001 3.2001 3.3597 3.3597 3.4560 3.4560 4.0196 4.0196 4.0450 4.0450 4.5817 4.5817 4.6573 4.6573 4.9382 4.9382 4.9735 4.9735 5.4033 5.4033 10.6864 10.6864 11.7295 11.7295 11.7378 11.7378 12.5338 12.5338 12.7856 12.7856 k = 0.6035 0.1215-0.8424 ( 4222 PWs) bands (ev): -34.2098 -34.2098 -34.1778 -34.1778 -15.5512 -15.5512 -15.4028 -15.4028 -14.3489 -14.3489 -14.1640 -14.1640 -13.8647 -13.8647 -13.7285 -13.7285 -9.6849 -9.6849 -9.5986 -9.5986 -7.3732 -7.3732 -7.2618 -7.2618 2.4603 2.4603 2.9371 2.9371 3.2020 3.2020 3.3351 3.3351 3.4683 3.4683 3.9938 3.9938 4.0513 4.0513 4.5588 4.5588 4.6733 4.6733 4.9640 4.9640 4.9959 4.9959 5.4126 5.4126 10.6993 10.6993 11.7109 11.7109 11.7205 11.7205 12.5375 12.5375 12.7532 12.7532 k = 0.6000 0.1208-0.8124 ( 4219 PWs) bands (ev): -34.2115 -34.2115 -34.1783 -34.1783 -15.5440 -15.5440 -15.3885 -15.3885 -14.3427 -14.3427 -14.1497 -14.1497 -13.8626 -13.8626 -13.7263 -13.7263 -9.7069 -9.7069 -9.6185 -9.6185 -7.3827 -7.3827 -7.2653 -7.2653 2.4753 2.4753 2.9289 2.9289 3.2012 3.2012 3.3099 3.3099 3.4860 3.4860 3.9539 3.9539 4.0747 4.0747 4.5343 4.5343 4.6912 4.6912 4.9864 4.9864 5.0194 5.0194 5.4212 5.4212 10.7106 10.7106 11.6912 11.6912 11.7024 11.7024 12.5382 12.5382 12.7205 12.7205 k = 0.5966 0.1201-0.7823 ( 4221 PWs) bands (ev): -34.2131 -34.2131 -34.1789 -34.1789 -15.5367 -15.5367 -15.3741 -15.3741 -14.3360 -14.3360 -14.1349 -14.1349 -13.8601 -13.8601 -13.7242 -13.7242 -9.7298 -9.7298 -9.6397 -9.6397 -7.3921 -7.3921 -7.2686 -7.2686 2.4872 2.4872 2.9235 2.9235 3.1981 3.1981 3.2842 3.2842 3.5089 3.5089 3.9128 3.9128 4.1024 4.1024 4.5089 4.5089 4.7102 4.7102 5.0064 5.0064 5.0427 5.0427 5.4292 5.4292 10.7203 10.7203 11.6701 11.6701 11.6838 11.6838 12.5355 12.5355 12.6877 12.6877 k = 0.5931 0.1194-0.7522 ( 4211 PWs) bands (ev): -34.2148 -34.2148 -34.1795 -34.1795 -15.5294 -15.5294 -15.3598 -15.3598 -14.3288 -14.3288 -14.1196 -14.1196 -13.8572 -13.8572 -13.7222 -13.7222 -9.7535 -9.7535 -9.6619 -9.6619 -7.4013 -7.4013 -7.2716 -7.2716 2.4961 2.4961 2.9206 2.9206 3.1931 3.1931 3.2583 3.2583 3.5363 3.5363 3.8713 3.8713 4.1331 4.1331 4.4833 4.4833 4.7301 4.7301 5.0250 5.0250 5.0647 5.0647 5.4368 5.4368 10.7285 10.7285 11.6475 11.6475 11.6652 11.6652 12.5289 12.5289 12.6549 12.6549 k = 0.5897 0.1187-0.7222 ( 4210 PWs) bands (ev): -34.2165 -34.2165 -34.1802 -34.1802 -15.5220 -15.5220 -15.3454 -15.3454 -14.3213 -14.3213 -14.1039 -14.1039 -13.8537 -13.8537 -13.7202 -13.7202 -9.7781 -9.7781 -9.6852 -9.6852 -7.4101 -7.4101 -7.2743 -7.2743 2.5025 2.5025 2.9200 2.9200 3.1865 3.1865 3.2325 3.2325 3.5676 3.5676 3.8297 3.8297 4.1662 4.1662 4.4583 4.4583 4.7507 4.7507 5.0424 5.0424 5.0848 5.0848 5.4439 5.4439 10.7354 10.7354 11.6235 11.6235 11.6465 11.6465 12.5181 12.5181 12.6222 12.6222 k = 0.5862 0.1180-0.6921 ( 4211 PWs) bands (ev): -34.2182 -34.2182 -34.1808 -34.1808 -15.5147 -15.5147 -15.3312 -15.3312 -14.3134 -14.3134 -14.0877 -14.0877 -13.8498 -13.8498 -13.7182 -13.7182 -9.8033 -9.8033 -9.7095 -9.7095 -7.4186 -7.4186 -7.2767 -7.2767 2.5068 2.5068 2.9213 2.9213 3.1781 3.1781 3.2075 3.2075 3.6020 3.6020 3.7882 3.7882 4.2005 4.2005 4.4350 4.4350 4.7719 4.7719 5.0588 5.0588 5.1025 5.1025 5.4508 5.4508 10.7412 10.7412 11.5985 11.5985 11.6278 11.6278 12.5029 12.5029 12.5899 12.5899 k = 0.5828 0.1173-0.6620 ( 4208 PWs) bands (ev): -34.2198 -34.2198 -34.1815 -34.1815 -15.5075 -15.5075 -15.3172 -15.3172 -14.3051 -14.3051 -14.0711 -14.0711 -13.8453 -13.8453 -13.7164 -13.7164 -9.8291 -9.8291 -9.7347 -9.7347 -7.4267 -7.4267 -7.2788 -7.2788 2.5098 2.5098 2.9242 2.9242 3.1663 3.1663 3.1852 3.1852 3.6382 3.6382 3.7469 3.7469 4.2344 4.2344 4.4156 4.4156 4.7936 4.7936 5.0740 5.0740 5.1180 5.1180 5.4576 5.4576 10.7460 10.7460 11.5726 11.5726 11.6090 11.6090 12.4831 12.4831 12.5580 12.5580 k = 0.5793 0.1166-0.6319 ( 4206 PWs) bands (ev): -34.2215 -34.2215 -34.1821 -34.1821 -15.5003 -15.5003 -15.3034 -15.3034 -14.2966 -14.2966 -14.0542 -14.0542 -13.8403 -13.8403 -13.7146 -13.7146 -9.8555 -9.8555 -9.7607 -9.7607 -7.4345 -7.4345 -7.2805 -7.2805 2.5119 2.5119 2.9284 2.9284 3.1470 3.1470 3.1701 3.1701 3.6748 3.6748 3.7062 3.7062 4.2647 4.2647 4.4038 4.4038 4.8157 4.8157 5.0875 5.0875 5.1315 5.1315 5.4644 5.4644 10.7502 10.7502 11.5461 11.5461 11.5902 11.5902 12.4591 12.4591 12.5262 12.5262 k = 0.5759 0.1159-0.6019 ( 4214 PWs) bands (ev): -34.2231 -34.2231 -34.1828 -34.1828 -15.4934 -15.4934 -15.2900 -15.2900 -14.2879 -14.2879 -14.0370 -14.0370 -13.8348 -13.8348 -13.7129 -13.7129 -9.8823 -9.8823 -9.7873 -9.7873 -7.4418 -7.4418 -7.2819 -7.2819 2.5138 2.5138 2.9337 2.9337 3.1233 3.1233 3.1595 3.1595 3.6657 3.6657 3.7103 3.7103 4.2859 4.2859 4.4062 4.4062 4.8381 4.8381 5.0985 5.0985 5.1439 5.1439 5.4711 5.4711 10.7540 10.7540 11.5195 11.5195 11.5713 11.5713 12.4317 12.4317 12.4942 12.4942 k = 0.5724 0.1152-0.5718 ( 4219 PWs) bands (ev): -34.2247 -34.2247 -34.1835 -34.1835 -15.4866 -15.4866 -15.2769 -15.2769 -14.2791 -14.2791 -14.0197 -14.0197 -13.8287 -13.8287 -13.7112 -13.7112 -9.9095 -9.9095 -9.8145 -9.8145 -7.4487 -7.4487 -7.2829 -7.2829 2.5159 2.5159 2.9399 2.9399 3.0987 3.0987 3.1500 3.1500 3.6263 3.6263 3.7415 3.7415 4.2963 4.2963 4.4260 4.4260 4.8607 4.8607 5.1064 5.1064 5.1559 5.1559 5.4778 5.4778 10.7575 10.7575 11.4928 11.4928 11.5524 11.5524 12.4016 12.4016 12.4616 12.4616 k = 0.5690 0.1145-0.5417 ( 4225 PWs) bands (ev): -34.2263 -34.2263 -34.1842 -34.1842 -15.4801 -15.4801 -15.2642 -15.2642 -14.2701 -14.2701 -14.0021 -14.0021 -13.8220 -13.8220 -13.7097 -13.7097 -9.9368 -9.9368 -9.8421 -9.8421 -7.4551 -7.4551 -7.2836 -7.2836 2.5187 2.5187 2.9470 2.9470 3.0742 3.0742 3.1409 3.1409 3.5877 3.5877 3.7662 3.7662 4.3028 4.3028 4.4581 4.4581 4.8834 4.8834 5.1107 5.1107 5.1682 5.1682 5.4844 5.4844 10.7611 10.7611 11.4664 11.4664 11.5334 11.5334 12.3697 12.3697 12.4283 12.4283 k = 0.5655 0.1138-0.5117 ( 4225 PWs) bands (ev): -34.2279 -34.2279 -34.1849 -34.1849 -15.4738 -15.4738 -15.2519 -15.2519 -14.2612 -14.2612 -13.9845 -13.9845 -13.8148 -13.8148 -13.7082 -13.7082 -9.9642 -9.9642 -9.8700 -9.8700 -7.4611 -7.4611 -7.2841 -7.2841 2.5224 2.5224 2.9548 2.9548 3.0502 3.0502 3.1321 3.1321 3.5501 3.5501 3.7816 3.7816 4.3139 4.3139 4.4959 4.4959 4.9060 4.9060 5.1116 5.1116 5.1809 5.1809 5.4906 5.4906 10.7648 10.7648 11.4406 11.4406 11.5146 11.5146 12.3366 12.3366 12.3944 12.3944 k = 0.5621 0.1131-0.4816 ( 4226 PWs) bands (ev): -34.2293 -34.2293 -34.1856 -34.1856 -15.4677 -15.4677 -15.2402 -15.2402 -14.2523 -14.2523 -13.9670 -13.9670 -13.8071 -13.8071 -13.7068 -13.7068 -9.9915 -9.9915 -9.8979 -9.8979 -7.4667 -7.4667 -7.2843 -7.2843 2.5274 2.5274 2.9632 2.9632 3.0271 3.0271 3.1236 3.1236 3.5136 3.5136 3.7860 3.7860 4.3339 4.3339 4.5356 4.5356 4.9284 4.9284 5.1098 5.1098 5.1938 5.1938 5.4964 5.4964 10.7689 10.7689 11.4157 11.4157 11.4958 11.4958 12.3026 12.3026 12.3604 12.3604 k = 0.5586 0.1124-0.4515 ( 4227 PWs) bands (ev): -34.2308 -34.2308 -34.1863 -34.1863 -15.4620 -15.4620 -15.2289 -15.2289 -14.2436 -14.2436 -13.9495 -13.9495 -13.7990 -13.7990 -13.7055 -13.7055 -10.0186 -10.0186 -9.9258 -9.9258 -7.4718 -7.4718 -7.2842 -7.2842 2.5339 2.5339 2.9716 2.9716 3.0053 3.0053 3.1155 3.1155 3.4784 3.4784 3.7793 3.7793 4.3640 4.3640 4.5753 4.5753 4.9504 4.9504 5.1063 5.1063 5.2066 5.2066 5.5016 5.5016 10.7733 10.7733 11.3919 11.3919 11.4771 11.4771 12.2681 12.2681 12.3269 12.3269 k = 0.5552 0.1117-0.4215 ( 4223 PWs) bands (ev): -34.2322 -34.2322 -34.1869 -34.1869 -15.4566 -15.4566 -15.2183 -15.2183 -14.2350 -14.2350 -13.9322 -13.9322 -13.7905 -13.7905 -13.7042 -13.7042 -10.0454 -10.0454 -9.9534 -9.9534 -7.4765 -7.4765 -7.2839 -7.2839 2.5420 2.5420 2.9743 2.9743 2.9907 2.9907 3.1079 3.1079 3.4445 3.4445 3.7627 3.7627 4.4033 4.4033 4.6138 4.6138 4.9718 4.9718 5.1020 5.1020 5.2192 5.2192 5.5059 5.5059 10.7783 10.7783 11.3695 11.3695 11.4588 11.4588 12.2333 12.2333 12.2941 12.2941 k = 0.5517 0.1111-0.3914 ( 4217 PWs) bands (ev): -34.2335 -34.2335 -34.1875 -34.1875 -15.4514 -15.4514 -15.2082 -15.2082 -14.2268 -14.2268 -13.9151 -13.9151 -13.7816 -13.7816 -13.7031 -13.7031 -10.0716 -10.0716 -9.9807 -9.9807 -7.4807 -7.4807 -7.2834 -7.2834 2.5517 2.5517 2.9585 2.9585 2.9958 2.9958 3.1011 3.1011 3.4121 3.4121 3.7381 3.7381 4.4496 4.4496 4.6501 4.6501 4.9923 4.9923 5.0981 5.0981 5.2312 5.2312 5.5091 5.5091 10.7837 10.7837 11.3488 11.3488 11.4407 11.4407 12.1985 12.1985 12.2626 12.2626 k = 0.5483 0.1104-0.3613 ( 4219 PWs) bands (ev): -34.2348 -34.2348 -34.1882 -34.1882 -15.4467 -15.4467 -15.1987 -15.1987 -14.2189 -14.2189 -13.8984 -13.8984 -13.7726 -13.7726 -13.7020 -13.7020 -10.0971 -10.0971 -10.0074 -10.0074 -7.4846 -7.4846 -7.2827 -7.2827 2.5633 2.5633 2.9394 2.9394 3.0054 3.0054 3.0951 3.0951 3.3812 3.3812 3.7076 3.7076 4.5007 4.5007 4.6834 4.6834 5.0111 5.0111 5.0962 5.0962 5.2426 5.2426 5.5111 5.5111 10.7895 10.7895 11.3300 11.3300 11.4231 11.4231 12.1638 12.1638 12.2326 12.2326 k = 0.5448 0.1097-0.3312 ( 4224 PWs) bands (ev): -34.2360 -34.2360 -34.1887 -34.1887 -15.4422 -15.4422 -15.1898 -15.1898 -14.2114 -14.2114 -13.8821 -13.8821 -13.7635 -13.7635 -13.7009 -13.7009 -10.1217 -10.1217 -10.0333 -10.0333 -7.4881 -7.4881 -7.2819 -7.2819 2.5765 2.5765 2.9209 2.9209 3.0150 3.0150 3.0906 3.0906 3.3520 3.3520 3.6727 3.6727 4.5540 4.5540 4.7132 4.7132 5.0278 5.0278 5.0980 5.0980 5.2533 5.2533 5.5116 5.5116 10.7957 10.7957 11.3134 11.3134 11.4060 11.4060 12.1296 12.1296 12.2042 12.2042 k = 0.5414 0.1090-0.3012 ( 4224 PWs) bands (ev): -34.2371 -34.2371 -34.1893 -34.1893 -15.4381 -15.4381 -15.1815 -15.1815 -14.2043 -14.2043 -13.8664 -13.8664 -13.7546 -13.7546 -13.6998 -13.6998 -10.1454 -10.1454 -10.0582 -10.0582 -7.4912 -7.4912 -7.2811 -7.2811 2.5915 2.5915 2.9033 2.9033 3.0236 3.0236 3.0880 3.0880 3.3246 3.3246 3.6348 3.6348 4.6067 4.6067 4.7403 4.7403 5.0419 5.0419 5.1046 5.1046 5.2632 5.2632 5.5104 5.5104 10.8022 10.8022 11.2992 11.2992 11.3896 11.3896 12.0962 12.0962 12.1775 12.1775 k = 0.5379 0.1083-0.2711 ( 4222 PWs) bands (ev): -34.2382 -34.2382 -34.1898 -34.1898 -15.4343 -15.4343 -15.1739 -15.1739 -14.1977 -14.1977 -13.8512 -13.8512 -13.7460 -13.7460 -13.6986 -13.6986 -10.1679 -10.1679 -10.0821 -10.0821 -7.4940 -7.4940 -7.2801 -7.2801 2.6082 2.6082 2.8870 2.8870 3.0301 3.0301 3.0884 3.0884 3.2991 3.2991 3.5949 3.5949 4.6544 4.6544 4.7672 4.7672 5.0540 5.0540 5.1158 5.1158 5.2722 5.2722 5.5074 5.5074 10.8088 10.8088 11.2875 11.2875 11.3739 11.3739 12.0638 12.0638 12.1527 12.1527 k = 0.5345 0.1076-0.2410 ( 4224 PWs) bands (ev): -34.2392 -34.2392 -34.1903 -34.1903 -15.4309 -15.4309 -15.1670 -15.1670 -14.1916 -14.1916 -13.8367 -13.8367 -13.7380 -13.7380 -13.6972 -13.6972 -10.1890 -10.1890 -10.1046 -10.1046 -7.4964 -7.4964 -7.2791 -7.2791 2.6264 2.6264 2.8718 2.8718 3.0336 3.0336 3.0922 3.0922 3.2755 3.2755 3.5540 3.5540 4.6901 4.6901 4.8000 4.8000 5.0658 5.0658 5.1303 5.1303 5.2802 5.2802 5.5023 5.5023 10.8153 10.8153 11.2784 11.2784 11.3591 11.3591 12.0326 12.0326 12.1297 12.1297 k = 0.5310 0.1069-0.2110 ( 4228 PWs) bands (ev): -34.2401 -34.2401 -34.1908 -34.1908 -15.4278 -15.4278 -15.1607 -15.1607 -14.1861 -14.1861 -13.8230 -13.8230 -13.7311 -13.7311 -13.6953 -13.6953 -10.2086 -10.2086 -10.1256 -10.1256 -7.4986 -7.4986 -7.2782 -7.2782 2.6459 2.6459 2.8581 2.8581 3.0344 3.0344 3.0991 3.0991 3.2539 3.2539 3.5128 3.5128 4.7097 4.7097 4.8428 4.8428 5.0784 5.0784 5.1462 5.1462 5.2872 5.2872 5.4951 5.4951 10.8217 10.8217 11.2718 11.2718 11.3453 11.3453 12.0027 12.0027 12.1087 12.1087 k = 0.5276 0.1062-0.1809 ( 4227 PWs) bands (ev): -34.2409 -34.2409 -34.1912 -34.1912 -15.4251 -15.4251 -15.1550 -15.1550 -14.1811 -14.1811 -13.8101 -13.8101 -13.7255 -13.7255 -13.6928 -13.6928 -10.2266 -10.2266 -10.1449 -10.1449 -7.5004 -7.5004 -7.2772 -7.2772 2.6664 2.6664 2.8457 2.8457 3.0335 3.0335 3.1078 3.1078 3.2345 3.2345 3.4719 3.4719 4.7168 4.7168 4.8925 4.8925 5.0917 5.0917 5.1625 5.1625 5.2932 5.2932 5.4855 5.4855 10.8277 10.8277 11.2678 11.2678 11.3327 11.3327 11.9742 11.9742 12.0895 12.0895 k = 0.5241 0.1055-0.1508 ( 4225 PWs) bands (ev): -34.2416 -34.2416 -34.1915 -34.1915 -15.4227 -15.4227 -15.1501 -15.1501 -14.1767 -14.1767 -13.7981 -13.7981 -13.7216 -13.7216 -13.6896 -13.6896 -10.2429 -10.2429 -10.1624 -10.1624 -7.5020 -7.5020 -7.2763 -7.2763 2.6876 2.6876 2.8348 2.8348 3.0316 3.0316 3.1172 3.1172 3.2172 3.2172 3.4320 3.4320 4.7165 4.7165 4.9444 4.9444 5.1056 5.1056 5.1784 5.1784 5.2981 5.2981 5.4735 5.4735 10.8333 10.8333 11.2659 11.2659 11.3213 11.3213 11.9473 11.9473 12.0723 12.0723 k = 0.5207 0.1048-0.1207 ( 4225 PWs) bands (ev): -34.2422 -34.2422 -34.1919 -34.1919 -15.4206 -15.4206 -15.1458 -15.1458 -14.1729 -14.1729 -13.7871 -13.7871 -13.7193 -13.7193 -13.6857 -13.6857 -10.2572 -10.2572 -10.1780 -10.1780 -7.5034 -7.5034 -7.2755 -7.2755 2.7090 2.7090 2.8255 2.8255 3.0295 3.0295 3.1264 3.1264 3.2022 3.2022 3.3940 3.3940 4.7123 4.7123 4.9955 4.9955 5.1198 5.1198 5.1933 5.1933 5.3019 5.3019 5.4590 5.4590 10.8383 10.8383 11.2660 11.2660 11.3114 11.3114 11.9221 11.9221 12.0568 12.0568 k = 0.5172 0.1041-0.0907 ( 4221 PWs) bands (ev): -34.2428 -34.2428 -34.1921 -34.1921 -15.4188 -15.4188 -15.1421 -15.1421 -14.1697 -14.1697 -13.7772 -13.7772 -13.7185 -13.7185 -13.6816 -13.6816 -10.2695 -10.2695 -10.1913 -10.1913 -7.5045 -7.5045 -7.2747 -7.2747 2.7296 2.7296 2.8180 2.8180 3.0274 3.0274 3.1348 3.1348 3.1896 3.1896 3.3586 3.3586 4.7063 4.7063 5.0437 5.0437 5.1343 5.1343 5.2069 5.2069 5.3045 5.3045 5.4420 5.4420 10.8426 10.8426 11.2673 11.2673 11.3030 11.3030 11.8990 11.8990 12.0428 12.0428 k = 0.5138 0.1034-0.0606 ( 4225 PWs) bands (ev): -34.2432 -34.2432 -34.1924 -34.1924 -15.4174 -15.4174 -15.1391 -15.1391 -14.1670 -14.1670 -13.7684 -13.7684 -13.7187 -13.7187 -13.6777 -13.6777 -10.2798 -10.2798 -10.2025 -10.2025 -7.5054 -7.5054 -7.2741 -7.2741 2.7485 2.7485 2.8124 2.8124 3.0255 3.0255 3.1416 3.1416 3.1796 3.1796 3.3269 3.3269 4.6999 4.6999 5.0856 5.0856 5.1511 5.1511 5.2186 5.2186 5.3056 5.3056 5.4230 5.4230 10.8462 10.8462 11.2693 11.2693 11.2965 11.2965 11.8784 11.8784 12.0302 12.0302 k = 0.5103 0.1027-0.0305 ( 4225 PWs) bands (ev): -34.2435 -34.2435 -34.1925 -34.1925 -15.4163 -15.4163 -15.1368 -15.1368 -14.1650 -14.1650 -13.7609 -13.7609 -13.7197 -13.7197 -13.6744 -13.6744 -10.2878 -10.2878 -10.2113 -10.2113 -7.5061 -7.5061 -7.2736 -7.2736 2.7641 2.7641 2.8094 2.8094 3.0240 3.0240 3.1462 3.1462 3.1727 3.1727 3.3002 3.3002 4.6941 4.6941 5.1156 5.1156 5.1747 5.1747 5.2283 5.2283 5.3047 5.3047 5.4025 5.4025 10.8490 10.8490 11.2710 11.2710 11.2920 11.2920 11.8612 11.8612 12.0191 12.0191 k = 0.5069 0.1020-0.0005 ( 4235 PWs) bands (ev): -34.2438 -34.2438 -34.1927 -34.1927 -15.4155 -15.4155 -15.1352 -15.1352 -14.1635 -14.1635 -13.7550 -13.7550 -13.7210 -13.7210 -13.6719 -13.6719 -10.2936 -10.2936 -10.2176 -10.2176 -7.5065 -7.5065 -7.2732 -7.2732 2.7745 2.7745 2.8094 2.8094 3.0229 3.0229 3.1481 3.1481 3.1691 3.1691 3.2797 3.2797 4.6895 4.6895 5.1318 5.1318 5.2056 5.2056 5.2359 5.2359 5.3004 5.3004 5.3826 5.3826 10.8510 10.8510 11.2719 11.2719 11.2897 11.2897 11.8482 11.8482 12.0107 12.0107 k = 0.5034 0.1013 0.0296 ( 4232 PWs) bands (ev): -34.2439 -34.2439 -34.1928 -34.1928 -15.4150 -15.4150 -15.1342 -15.1342 -14.1626 -14.1626 -13.7510 -13.7510 -13.7222 -13.7222 -13.6703 -13.6703 -10.2971 -10.2971 -10.2214 -10.2214 -7.5068 -7.5068 -7.2730 -7.2730 2.7793 2.7793 2.8115 2.8115 3.0223 3.0223 3.1481 3.1481 3.1680 3.1680 3.2668 3.2668 4.6865 4.6865 5.1393 5.1393 5.2332 5.2332 5.2454 5.2454 5.2897 5.2897 5.3673 5.3673 10.8522 10.8522 11.2720 11.2720 11.2890 11.2890 11.8401 11.8401 12.0056 12.0056 k = 0.5000 0.1006 0.0597 ( 4238 PWs) bands (ev): -34.2440 -34.2440 -34.1928 -34.1928 -15.4149 -15.4149 -15.1338 -15.1338 -14.1623 -14.1623 -13.7496 -13.7496 -13.7227 -13.7227 -13.6698 -13.6698 -10.2983 -10.2983 -10.2227 -10.2227 -7.5069 -7.5069 -7.2729 -7.2729 2.7806 2.7806 2.8127 2.8127 3.0220 3.0220 3.1479 3.1479 3.1678 3.1678 3.2624 3.2624 4.6855 4.6855 5.1415 5.1415 5.2385 5.2385 5.2675 5.2675 5.2719 5.2719 5.3615 5.3615 10.8526 10.8526 11.2720 11.2720 11.2889 11.2889 11.8373 11.8373 12.0039 12.0039 k = 0.5000-1.1918-0.7067 ( 4218 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6202 -15.6202 -15.5684 -15.5684 -14.3912 -14.3912 -14.3042 -14.3042 -13.8650 -13.8650 -13.7586 -13.7586 -9.4623 -9.4623 -9.4536 -9.4536 -7.2587 -7.2587 -7.1984 -7.1984 2.1602 2.1602 2.9414 2.9414 3.3017 3.3017 3.4492 3.4492 3.6139 3.6139 4.0847 4.0847 4.4248 4.4248 4.5778 4.5778 4.6235 4.6235 4.6667 4.6667 4.9370 4.9370 5.0586 5.0586 10.4532 10.4532 11.7266 11.7266 11.9369 11.9369 12.4187 12.4187 12.9913 12.9913 k = 0.5270-1.1834-0.7017 ( 4218 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6202 -15.6202 -15.5684 -15.5684 -14.3912 -14.3912 -14.3042 -14.3042 -13.8650 -13.8650 -13.7586 -13.7586 -9.4623 -9.4623 -9.4536 -9.4536 -7.2587 -7.2587 -7.1985 -7.1985 2.1597 2.1597 2.9425 2.9425 3.3011 3.3011 3.4505 3.4505 3.6138 3.6138 4.0834 4.0834 4.4250 4.4250 4.5776 4.5776 4.6229 4.6229 4.6672 4.6672 4.9325 4.9325 5.0630 5.0630 10.4530 10.4530 11.7274 11.7274 11.9367 11.9367 12.4185 12.4185 12.9918 12.9918 k = 0.5540-1.1750-0.6967 ( 4221 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6202 -15.6202 -15.5684 -15.5684 -14.3912 -14.3912 -14.3042 -14.3042 -13.8650 -13.8650 -13.7586 -13.7586 -9.4624 -9.4624 -9.4536 -9.4536 -7.2584 -7.2584 -7.1987 -7.1987 2.1582 2.1582 2.9457 2.9457 3.2995 3.2995 3.4544 3.4544 3.6137 3.6137 4.0794 4.0794 4.4258 4.4258 4.5769 4.5769 4.6214 4.6214 4.6688 4.6688 4.9210 4.9210 5.0745 5.0745 10.4523 10.4523 11.7300 11.7300 11.9361 11.9361 12.4179 12.4179 12.9931 12.9931 k = 0.5811-1.1666-0.6917 ( 4229 PWs) bands (ev): -34.1909 -34.1909 -34.1740 -34.1740 -15.6202 -15.6202 -15.5683 -15.5683 -14.3912 -14.3912 -14.3042 -14.3042 -13.8650 -13.8650 -13.7585 -13.7585 -9.4624 -9.4624 -9.4537 -9.4537 -7.2580 -7.2580 -7.1991 -7.1991 2.1557 2.1557 2.9509 2.9509 3.2971 3.2971 3.4605 3.4605 3.6135 3.6135 4.0731 4.0731 4.4269 4.4269 4.5750 4.5750 4.6194 4.6194 4.6710 4.6710 4.9061 4.9061 5.0898 5.0898 10.4512 10.4512 11.7341 11.7341 11.9351 11.9351 12.4167 12.4167 12.9955 12.9955 k = 0.6081-1.1582-0.6868 ( 4230 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6202 -15.6202 -15.5683 -15.5683 -14.3912 -14.3912 -14.3041 -14.3041 -13.8650 -13.8650 -13.7585 -13.7585 -9.4626 -9.4626 -9.4537 -9.4537 -7.2574 -7.2574 -7.1997 -7.1997 2.1524 2.1524 2.9579 2.9579 3.2943 3.2943 3.4684 3.4684 3.6132 3.6132 4.0648 4.0648 4.4285 4.4285 4.5710 4.5710 4.6173 4.6173 4.6737 4.6737 4.8909 4.8909 5.1064 5.1064 10.4498 10.4498 11.7398 11.7398 11.9339 11.9339 12.4150 12.4150 12.9993 12.9993 k = 0.6351-1.1498-0.6818 ( 4228 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6202 -15.6202 -15.5682 -15.5682 -14.3912 -14.3912 -14.3041 -14.3041 -13.8650 -13.8650 -13.7585 -13.7585 -9.4627 -9.4627 -9.4537 -9.4537 -7.2567 -7.2567 -7.2004 -7.2004 2.1484 2.1484 2.9665 2.9665 3.2914 3.2914 3.4776 3.4776 3.6128 3.6128 4.0551 4.0551 4.4302 4.4302 4.5643 4.5643 4.6150 4.6150 4.6765 4.6765 4.8775 4.8775 5.1230 5.1230 10.4480 10.4480 11.7469 11.7469 11.9323 11.9323 12.4125 12.4125 13.0048 13.0048 k = 0.6621-1.1414-0.6768 ( 4230 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6202 -15.6202 -15.5681 -15.5681 -14.3912 -14.3912 -14.3040 -14.3040 -13.8650 -13.8650 -13.7585 -13.7585 -9.4629 -9.4629 -9.4537 -9.4537 -7.2559 -7.2559 -7.2013 -7.2013 2.1439 2.1439 2.9763 2.9763 3.2888 3.2888 3.4877 3.4877 3.6123 3.6123 4.0444 4.0444 4.4321 4.4321 4.5544 4.5544 4.6123 4.6123 4.6792 4.6792 4.8675 4.8675 5.1388 5.1388 10.4459 10.4459 11.7553 11.7553 11.9306 11.9306 12.4091 12.4091 13.0122 13.0122 k = 0.6891-1.1331-0.6718 ( 4232 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6202 -15.6202 -15.5680 -15.5680 -14.3912 -14.3912 -14.3039 -14.3039 -13.8650 -13.8650 -13.7584 -13.7584 -9.4631 -9.4631 -9.4537 -9.4537 -7.2549 -7.2549 -7.2023 -7.2023 2.1389 2.1389 2.9871 2.9871 3.2869 3.2869 3.4981 3.4981 3.6118 3.6118 4.0333 4.0333 4.4338 4.4338 4.5413 4.5413 4.6091 4.6091 4.6818 4.6818 4.8615 4.8615 5.1534 5.1534 10.4437 10.4437 11.7648 11.7648 11.9286 11.9286 12.4049 12.4049 13.0219 13.0219 k = 0.7161-1.1247-0.6669 ( 4235 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6202 -15.6202 -15.5679 -15.5679 -14.3912 -14.3912 -14.3038 -14.3038 -13.8650 -13.8650 -13.7584 -13.7584 -9.4634 -9.4634 -9.4537 -9.4537 -7.2539 -7.2539 -7.2034 -7.2034 2.1337 2.1337 2.9984 2.9984 3.2858 3.2858 3.5085 3.5085 3.6112 3.6112 4.0224 4.0224 4.4350 4.4350 4.5256 4.5256 4.6054 4.6054 4.6841 4.6841 4.8600 4.8600 5.1665 5.1665 10.4413 10.4413 11.7751 11.7751 11.9266 11.9266 12.3996 12.3996 13.0340 13.0340 k = 0.7432-1.1163-0.6619 ( 4233 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6201 -15.6201 -15.5677 -15.5677 -14.3911 -14.3911 -14.3037 -14.3037 -13.8650 -13.8650 -13.7583 -13.7583 -9.4637 -9.4637 -9.4538 -9.4538 -7.2527 -7.2527 -7.2046 -7.2046 2.1284 2.1284 3.0098 3.0098 3.2858 3.2858 3.5183 3.5183 3.6106 3.6106 4.0121 4.0121 4.4348 4.4348 4.5084 4.5084 4.6013 4.6013 4.6861 4.6861 4.8623 4.8623 5.1779 5.1779 10.4388 10.4388 11.7860 11.7860 11.9245 11.9245 12.3935 12.3935 13.0485 13.0485 k = 0.7702-1.1079-0.6569 ( 4226 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6201 -15.6201 -15.5676 -15.5676 -14.3911 -14.3911 -14.3036 -14.3036 -13.8650 -13.8650 -13.7583 -13.7583 -9.4640 -9.4640 -9.4537 -9.4537 -7.2515 -7.2515 -7.2059 -7.2059 2.1233 2.1233 3.0210 3.0210 3.2870 3.2870 3.5272 3.5272 3.6099 3.6099 4.0030 4.0030 4.4317 4.4317 4.4920 4.4920 4.5972 4.5972 4.6877 4.6877 4.8678 4.8678 5.1876 5.1876 10.4364 10.4364 11.7972 11.7972 11.9225 11.9225 12.3867 12.3867 13.0653 13.0653 k = 0.7972-1.0995-0.6520 ( 4230 PWs) bands (ev): -34.1910 -34.1910 -34.1740 -34.1740 -15.6201 -15.6201 -15.5674 -15.5674 -14.3911 -14.3911 -14.3035 -14.3035 -13.8651 -13.8651 -13.7582 -13.7582 -9.4643 -9.4643 -9.4537 -9.4537 -7.2503 -7.2503 -7.2072 -7.2072 2.1183 2.1183 3.0317 3.0317 3.2894 3.2894 3.5348 3.5348 3.6091 3.6091 3.9953 3.9953 4.4231 4.4231 4.4799 4.4799 4.5934 4.5934 4.6889 4.6889 4.8756 4.8756 5.1955 5.1955 10.4341 10.4341 11.8084 11.8084 11.9205 11.9205 12.3794 12.3794 13.0841 13.0841 k = 0.8242-1.0911-0.6470 ( 4222 PWs) bands (ev): -34.1911 -34.1911 -34.1740 -34.1740 -15.6200 -15.6200 -15.5672 -15.5672 -14.3911 -14.3911 -14.3033 -14.3033 -13.8651 -13.8651 -13.7582 -13.7582 -9.4647 -9.4647 -9.4537 -9.4537 -7.2491 -7.2491 -7.2086 -7.2086 2.1137 2.1137 3.0414 3.0414 3.2930 3.2930 3.5408 3.5408 3.6082 3.6082 3.9891 3.9891 4.4085 4.4085 4.4738 4.4738 4.5901 4.5901 4.6896 4.6896 4.8847 4.8847 5.2016 5.2016 10.4320 10.4320 11.8191 11.8191 11.9188 11.9188 12.3720 12.3720 13.1042 13.1042 Writing output data file YClO.save init_run : 0.61s CPU 0.88s WALL ( 1 calls) electrons : 514.28s CPU 518.42s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.04s WALL ( 1 calls) potinit : 0.09s CPU 0.13s WALL ( 1 calls) Called by electrons: c_bands : 514.27s CPU 518.42s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.08s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.08s WALL ( 308 calls) cegterg : 463.87s CPU 466.81s WALL ( 607 calls) Called by sum_band: Called by *egterg: h_psi : 409.88s CPU 412.43s WALL ( 8357 calls) s_psi : 7.02s CPU 7.09s WALL ( 8357 calls) g_psi : 0.31s CPU 0.28s WALL ( 7442 calls) cdiaghg : 72.32s CPU 73.15s WALL ( 7750 calls) cegterg:over : 7.87s CPU 7.79s WALL ( 7442 calls) cegterg:upda : 7.03s CPU 7.09s WALL ( 7442 calls) cegterg:last : 3.03s CPU 2.98s WALL ( 1226 calls) cdiaghg:chol : 4.34s CPU 4.21s WALL ( 7750 calls) cdiaghg:inve : 2.94s CPU 2.97s WALL ( 7750 calls) cdiaghg:para : 4.79s CPU 4.78s WALL ( 15500 calls) Called by h_psi: h_psi:vloc : 393.20s CPU 395.67s WALL ( 8357 calls) h_psi:vnl : 16.39s CPU 16.48s WALL ( 8357 calls) add_vuspsi : 8.50s CPU 8.54s WALL ( 8357 calls) General routines calbec : 7.85s CPU 7.92s WALL ( 8357 calls) fft : 0.01s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 362.58s CPU 365.04s WALL ( 941980 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.19s CPU 0.33s WALL ( 616 calls) Parallel routines fft_scatter : 72.36s CPU 72.92s WALL ( 942003 calls) PWSCF : 8m52.24s CPU 9m22.72s WALL This run was terminated on: 17:39:58 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=