name: yttrium barium copper oxide ( 123 , ybco) Feff 7.023 formula: YBa2Cu3O7 sites: Y1,Ba1,Cu1,Cu2,O1-4 refer1: Sharma, et al, Physica C 174, p.409, (1991) refer2: Cava, et al, Physica C 165, p.419, (1990) notes: high-temperature superconductor Abs Z=29 Rmt= 1.003 Rnm= 1.266 K shell Pot 1 Z= 8 Rmt= 0.960 Rnm= 1.125 Pot 2 Z=56 Rmt= 1.770 Rnm= 1.956 Pot 3 Z=29 Rmt= 1.003 Rnm= 1.266 Pot 4 Z=39 Rmt= 1.474 Rnm= 1.805 Gam_ch=1.761E+00 H-L exch Mu=-5.406E+00 kf=1.838E+00 Vint=-1.828E+01 Rs_int= 1.973 S02 1.000 Temp 30.00 Debye temp 210.00 Global sig2 0.00000 Curved wave amplitude ratio filter 4.000% file sig2 tot cw amp ratio deg nlegs reff inp sig2 1 0.00943 100.00 2.00 2 1.8596 2 0.00982 90.65 2.00 2 1.9406 3 0.01650 15.57 8.00 3 3.2441 4 0.00412 100.00 8.00 2 3.4612 5 0.02249 9.12 2.00 3 3.7193 6 0.02249 8.67 2.00 4 3.7193 7 0.03772 4.01 2.00 4 3.7193 8 0.00567 12.12 2.00 2 3.8120 9 0.00568 11.59 2.00 2 3.8813 10 0.02255 7.75 2.00 3 3.8813 11 0.00568 31.06 4.00 3 3.8813 12 0.02255 7.17 2.00 4 3.8813 14 0.00568 20.69 2.00 4 3.8813 15 0.00760 13.83 16.00 3 4.0277 16 0.00566 9.93 2.00 2 4.1273 17 0.00566 25.99 4.00 3 4.1273 18 0.00566 16.82 2.00 4 4.1273 19 0.00814 10.49 16.00 3 4.1340 20 0.01431 14.71 4.00 2 4.2414 21 0.01430 14.36 4.00 2 4.2775 22 0.01429 14.11 4.00 2 4.3038 23 0.01491 14.04 8.00 3 4.4661 24 0.01968 4.97 8.00 4 4.5942 25 0.01843 5.26 4.00 4 4.6285 26 0.01411 10.30 4.00 2 4.7976 27 0.01411 10.22 4.00 2 4.8104 28 0.01474 12.53 8.00 3 4.9176 29 0.01475 12.18 8.00 3 4.9340 30 0.01748 5.11 4.00 4 5.0377 31 0.01758 4.93 4.00 4 5.0577 32 0.01204 11.86 16.00 3 5.0791 33 0.01196 9.35 16.00 3 5.1133 34 0.01210 10.38 16.00 3 5.2186 35 0.01217 10.55 16.00 3 5.2498 36 0.01219 9.19 16.00 3 5.3024 40 0.00551 9.57 4.00 2 5.4402 41 0.01266 9.14 16.00 3 5.6144 42 0.00553 8.75 4.00 2 5.6183 43 0.01265 8.96 16.00 3 5.6197 44 0.00553 8.55 4.00 2 5.6656 45 0.01409 11.93 8.00 2 5.7492 48 0.01411 6.11 4.00 3 5.8219 49 0.01411 5.18 4.00 3 5.8219 53 0.01411 6.43 4.00 4 5.8219 54 0.01411 5.58 4.00 4 5.8219 60 0.01411 6.94 4.00 5 5.8219 61 0.01411 6.71 4.00 5 5.8219 63 0.01411 4.19 2.00 6 5.8219 66 0.01364 16.83 16.00 3 5.9725 73 0.01423 9.73 8.00 2 6.1376 74 0.01425 9.56 8.00 2 6.1710 75 0.01624 4.20 16.00 3 6.1771 76 0.02204 4.65 8.00 3 6.1781 77 0.01467 6.76 8.00 4 6.1958 78 0.01399 17.77 16.00 3 6.2781 79 0.01401 17.73 16.00 3 6.3064 82 0.00418 19.64 8.00 2 6.4064 83 0.01463 9.21 8.00 4 6.4185 84 0.00487 15.35 8.00 2 6.4244 85 0.01463 9.33 8.00 4 6.4419 86 0.01598 4.34 16.00 3 6.4865 87 0.00419 18.92 8.00 2 6.4892 88 0.01601 4.22 16.00 3 6.5235 89 0.00561 11.21 16.00 3 6.5443 92 0.00503 12.55 16.00 3 6.6273 93 0.01558 4.73 16.00 4 6.6270 95 0.01563 4.66 16.00 4 6.6590 97 0.00585 4.85 16.00 3 6.6912 99 0.00580 4.82 16.00 3 6.7638 100 0.00780 4.51 8.00 4 6.7654 103 0.00487 9.07 16.00 3 6.7827 106 0.00577 10.01 8.00 2 6.8286 107 0.00577 41.66 16.00 3 6.8292 108 0.00577 45.78 8.00 4 6.8297 109 0.00421 9.67 16.00 3 6.8398 111 0.00421 9.41 16.00 3 6.9158 112 0.00268 8.32 8.00 3 6.9225 113 0.00268 6.40 8.00 4 6.9225 78/ 105 paths used xsedge+100, used to normalize mu 2.5363E-04 ----------------------------------------------------------------------- e, e(wrt edge), k, mu=(1+chi)*mu0, mu0, chi @# 8980.718 -10.457 -1.150 3.73357E-02 4.14255E-02 -9.87265E-02 8981.151 -10.024 -1.100 3.99826E-02 4.47741E-02 -1.07013E-01 8981.557 -9.618 -1.050 4.28659E-02 4.84749E-02 -1.15709E-01 8981.944 -9.231 -1.000 4.60743E-02 5.26556E-02 -1.24987E-01 8982.330 -8.845 -0.950 4.98621E-02 5.76719E-02 -1.35417E-01 8982.664 -8.511 -0.900 5.37318E-02 6.28821E-02 -1.45515E-01 8982.997 -8.178 -0.850 5.83316E-02 6.91811E-02 -1.56828E-01 8983.330 -7.845 -0.800 6.38960E-02 7.69447E-02 -1.69585E-01 8983.619 -7.556 -0.750 6.97520E-02 8.52715E-02 -1.82001E-01 8983.898 -7.278 -0.700 7.66581E-02 9.52799E-02 -1.95443E-01 8984.151 -7.025 -0.650 8.43448E-02 1.06635E-01 -2.09030E-01 8984.392 -6.784 -0.600 9.33678E-02 1.20215E-01 -2.23325E-01 8984.603 -6.572 -0.550 1.03125E-01 1.35156E-01 -2.36995E-01 8984.815 -6.360 -0.500 1.15157E-01 1.53868E-01 -2.51586E-01 8984.978 -6.197 -0.450 1.26407E-01 1.71565E-01 -2.63214E-01 8985.137 -6.038 -0.400 1.39450E-01 1.92218E-01 -2.74522E-01 8985.296 -5.879 -0.350 1.54862E-01 2.16649E-01 -2.85196E-01 8985.372 -5.803 -0.300 1.63129E-01 2.29707E-01 -2.89839E-01 8985.426 -5.749 -0.250 1.69323E-01 2.39448E-01 -2.92858E-01 8985.480 -5.696 -0.200 1.75813E-01 2.49601E-01 -2.95625E-01 8985.533 -5.642 -0.150 1.82589E-01 2.60136E-01 -2.98100E-01 8985.587 -5.588 -0.100 1.89637E-01 2.71006E-01 -3.00249E-01 8985.640 -5.535 -0.050 1.96935E-01 2.82159E-01 -3.02043E-01 8985.694 -5.481 0.000 2.04455E-01 2.93528E-01 -3.03456E-01 8985.748 -5.427 0.050 2.12165E-01 3.05041E-01 -3.04471E-01 8985.801 -5.374 0.100 2.20027E-01 3.16621E-01 -3.05078E-01 8985.875 -5.300 0.150 2.31046E-01 3.32558E-01 -3.05244E-01 8985.973 -5.203 0.200 2.45672E-01 3.53133E-01 -3.04306E-01 8986.070 -5.105 0.250 2.60259E-01 3.72933E-01 -3.02131E-01 8986.167 -5.008 0.300 2.74631E-01 3.91672E-01 -2.98825E-01 8986.264 -4.911 0.350 2.88674E-01 4.09177E-01 -2.94501E-01 8986.386 -4.789 0.400 3.05749E-01 4.29307E-01 -2.87808E-01 8986.560 -4.615 0.450 3.28949E-01 4.54531E-01 -2.76290E-01 8986.734 -4.442 0.500 3.50909E-01 4.76187E-01 -2.63086E-01 8986.929 -4.246 0.550 3.74217E-01 4.97050E-01 -2.47124E-01 8987.152 -4.024 0.600 3.98983E-01 5.17279E-01 -2.28690E-01 8987.382 -3.793 0.650 4.22576E-01 5.35240E-01 -2.10492E-01 8987.644 -3.531 0.700 4.46748E-01 5.52962E-01 -1.92082E-01 8987.920 -3.255 0.750 4.68945E-01 5.69350E-01 -1.76350E-01 8988.231 -2.944 0.800 4.89684E-01 5.85751E-01 -1.64006E-01 8988.542 -2.633 0.850 5.05788E-01 6.00557E-01 -1.57802E-01 8988.857 -2.318 0.900 5.17335E-01 6.14336E-01 -1.57896E-01 8989.224 -1.951 0.950 5.24665E-01 6.29212E-01 -1.66155E-01 8989.592 -1.584 1.000 5.25346E-01 6.43081E-01 -1.83079E-01 8989.976 -1.199 1.050 5.19828E-01 6.56732E-01 -2.08463E-01 8990.392 -0.783 1.100 5.10182E-01 6.70689E-01 -2.39317E-01 8990.809 -0.367 1.150 5.03245E-01 6.83935E-01 -2.64191E-01 8991.266 0.091 1.200 5.07641E-01 6.97788E-01 -2.72500E-01 8991.726 0.551 1.250 5.31129E-01 7.11055E-01 -2.53041E-01 8992.217 1.042 1.300 5.77908E-01 7.24558E-01 -2.02399E-01 8992.716 1.541 1.350 6.42597E-01 7.37682E-01 -1.28896E-01 8993.244 2.069 1.400 7.19164E-01 7.50913E-01 -4.22803E-02 8993.781 2.606 1.450 7.94888E-01 7.63726E-01 4.08022E-02 8994.349 3.173 1.500 8.63684E-01 7.76633E-01 1.12088E-01 8994.925 3.749 1.550 9.15982E-01 7.89075E-01 1.60831E-01 8995.528 4.353 1.600 9.49979E-01 8.01427E-01 1.85359E-01 8996.147 4.971 1.650 9.64527E-01 8.13400E-01 1.85797E-01 8996.781 5.606 1.700 9.63191E-01 8.24966E-01 1.67552E-01 8997.442 6.267 1.750 9.51894E-01 8.36291E-01 1.38233E-01 8998.117 6.942 1.800 9.38210E-01 8.47103E-01 1.07551E-01 8998.809 7.634 1.850 9.29431E-01 8.57416E-01 8.39915E-02 8999.527 8.352 1.900 9.31096E-01 8.67325E-01 7.35268E-02 9000.261 9.085 1.950 9.45878E-01 8.76639E-01 7.89813E-02 9001.011 9.836 2.000 9.73318E-01 8.85333E-01 9.93805E-02 9001.781 10.606 2.050 1.01055E+00 8.93347E-01 1.31198E-01 9002.574 11.399 2.100 1.05275E+00 9.00577E-01 1.68974E-01 9003.384 12.209 2.150 1.09298E+00 9.06864E-01 2.05226E-01 9004.212 13.037 2.200 1.12439E+00 9.12424E-01 2.32312E-01 9005.059 13.884 2.250 1.14256E+00 9.17797E-01 2.44897E-01 9005.925 14.750 2.300 1.14882E+00 9.23619E-01 2.43820E-01 9006.810 15.635 2.350 1.14936E+00 9.30314E-01 2.35454E-01 9007.716 16.540 2.400 1.14743E+00 9.37890E-01 2.23413E-01 9008.640 17.465 2.450 1.14273E+00 9.45997E-01 2.07960E-01 9009.583 18.408 2.500 1.13422E+00 9.54282E-01 1.88559E-01 9010.545 19.370 2.550 1.12111E+00 9.62459E-01 1.64840E-01 9011.526 20.351 2.600 1.10312E+00 9.70274E-01 1.36916E-01 9012.526 21.351 2.650 1.08063E+00 9.77488E-01 1.05517E-01 9013.546 22.370 2.700 1.05475E+00 9.83950E-01 7.19505E-02 9014.583 23.408 2.750 1.02733E+00 9.89670E-01 3.80549E-02 9015.640 24.465 2.800 1.00047E+00 9.94725E-01 5.77620E-03 9016.716 25.541 2.850 9.75880E-01 9.99115E-01 -2.32557E-02 9017.839 26.662 2.900 9.54263E-01 1.00290E+00 -4.84947E-02 9018.966 27.788 2.950 9.37223E-01 1.00623E+00 -6.85785E-02 9020.094 28.914 3.000 9.24763E-01 1.00929E+00 -8.37473E-02 9021.221 30.040 3.050 9.16185E-01 1.01199E+00 -9.46689E-02 9022.416 31.234 3.100 9.10085E-01 1.01418E+00 -1.02641E-01 9023.618 32.436 3.150 9.06015E-01 1.01597E+00 -1.08223E-01 9024.821 33.638 3.200 9.03278E-01 1.01753E+00 -1.12283E-01 9026.023 34.840 3.250 9.01402E-01 1.01880E+00 -1.15232E-01 9027.293 36.111 3.300 9.00179E-01 1.01958E+00 -1.17105E-01 9028.570 37.389 3.350 9.00546E-01 1.02001E+00 -1.17125E-01 9029.848 38.668 3.400 9.03580E-01 1.02030E+00 -1.14398E-01 9031.125 39.946 3.450 9.09942E-01 1.02042E+00 -1.08266E-01 9032.472 41.292 3.500 9.20218E-01 1.02024E+00 -9.80348E-02 9033.827 42.647 3.550 9.34344E-01 1.01987E+00 -8.38604E-02 9035.182 44.001 3.600 9.51607E-01 1.01941E+00 -6.65159E-02 9036.537 45.356 3.650 9.70421E-01 1.01884E+00 -4.75262E-02 9037.959 46.779 3.700 9.89604E-01 1.01802E+00 -2.79091E-02 9039.389 48.210 3.750 1.00697E+00 1.01706E+00 -9.91508E-03 9040.819 49.640 3.800 1.02129E+00 1.01604E+00 5.16030E-03 9042.249 51.071 3.850 1.03164E+00 1.01499E+00 1.64123E-02 9043.749 52.570 3.900 1.03779E+00 1.01381E+00 2.36496E-02 9045.256 54.077 3.950 1.03956E+00 1.01259E+00 2.66332E-02 9046.764 55.584 4.000 1.03757E+00 1.01136E+00 2.59178E-02 9048.271 57.091 4.050 1.03260E+00 1.01014E+00 2.22339E-02 9049.846 58.666 4.100 1.02534E+00 1.00892E+00 1.62734E-02 9051.428 60.249 4.150 1.01704E+00 1.00772E+00 9.25243E-03 9053.011 61.832 4.200 1.00893E+00 1.00653E+00 2.38817E-03 9054.593 63.415 4.250 1.00238E+00 1.00538E+00 -2.98247E-03 9056.245 65.067 4.300 9.98742E-01 1.00431E+00 -5.54106E-03 9057.905 66.726 4.350 9.99081E-01 1.00329E+00 -4.19577E-03 9059.565 68.385 4.400 1.00372E+00 1.00230E+00 1.42143E-03 9061.225 70.045 4.450 1.01243E+00 1.00136E+00 1.10517E-02 9062.952 71.772 4.500 1.02479E+00 1.00056E+00 2.42158E-02 9064.687 73.508 4.550 1.03882E+00 9.99842E-01 3.89876E-02 9066.422 75.243 4.600 1.05247E+00 9.99153E-01 5.33665E-02 9068.157 76.979 4.650 1.06387E+00 9.98527E-01 6.54420E-02 9069.961 78.783 4.700 1.07191E+00 9.98069E-01 7.39840E-02 9071.774 80.594 4.750 1.07513E+00 9.97699E-01 7.76114E-02 9073.586 82.406 4.800 1.07324E+00 9.97360E-01 7.60771E-02 9075.399 84.218 4.850 1.06668E+00 9.97077E-01 6.98076E-02 9077.279 86.098 4.900 1.05605E+00 9.96946E-01 5.92842E-02 9079.166 87.986 4.950 1.04216E+00 9.96891E-01 4.54127E-02 9081.054 89.874 5.000 1.02584E+00 9.96863E-01 2.90702E-02 9082.941 91.762 5.050 1.00807E+00 9.96886E-01 1.12148E-02 9084.898 93.718 5.100 9.89412E-01 9.97067E-01 -7.67697E-03 9086.863 95.682 5.150 9.71512E-01 9.97319E-01 -2.58763E-02 9088.828 97.646 5.200 9.55911E-01 9.97595E-01 -4.17840E-02 9090.793 99.610 5.250 9.44325E-01 9.97915E-01 -5.37020E-02 9092.825 101.643 5.300 9.38150E-01 9.98386E-01 -6.03334E-02 9094.865 103.683 5.350 9.38598E-01 9.98921E-01 -6.03878E-02 9096.905 105.723 5.400 9.45524E-01 9.99474E-01 -5.39785E-02 9098.945 107.764 5.450 9.57613E-01 1.00006E+00 -4.24428E-02 9101.052 109.872 5.500 9.73048E-01 1.00077E+00 -2.76959E-02 9103.167 111.989 5.550 9.88793E-01 1.00152E+00 -1.27052E-02 9105.282 114.105 5.600 1.00223E+00 1.00228E+00 -5.26891E-05 9107.397 116.222 5.650 1.01158E+00 1.00306E+00 8.49049E-03 9109.581 118.407 5.700 1.01640E+00 1.00393E+00 1.24195E-02 9111.774 120.599 5.750 1.01702E+00 1.00483E+00 1.21366E-02 9113.966 122.792 5.800 1.01487E+00 1.00572E+00 9.09754E-03 9116.159 124.985 5.850 1.01162E+00 1.00662E+00 4.97312E-03 9118.421 127.246 5.900 1.00849E+00 1.00754E+00 9.42394E-04 9120.691 129.515 5.950 1.00609E+00 1.00845E+00 -2.34440E-03 9122.961 131.784 6.000 1.00424E+00 1.00937E+00 -5.07865E-03 9125.231 134.053 6.050 1.00228E+00 1.01026E+00 -7.89905E-03 9127.568 136.390 6.100 9.99512E-01 1.01112E+00 -1.14836E-02 9129.913 138.735 6.150 9.96025E-01 1.01196E+00 -1.57478E-02 9132.258 141.080 6.200 9.92623E-01 1.01279E+00 -1.99096E-02 9134.603 143.425 6.250 9.90668E-01 1.01358E+00 -2.26092E-02 9137.017 145.838 6.300 9.91634E-01 1.01430E+00 -2.23438E-02 9139.440 148.260 6.350 9.96715E-01 1.01497E+00 -1.79846E-02 9141.862 150.681 6.400 1.00593E+00 1.01562E+00 -9.54536E-03 9144.285 153.103 6.450 1.01800E+00 1.01624E+00 1.72910E-03 9146.774 155.592 6.500 1.03089E+00 1.01673E+00 1.39315E-02 9149.272 158.090 6.550 1.04189E+00 1.01716E+00 2.43116E-02 9151.769 160.587 6.600 1.04885E+00 1.01757E+00 3.07459E-02 9154.267 163.085 6.650 1.05074E+00 1.01793E+00 3.22375E-02 9156.831 165.650 6.700 1.04777E+00 1.01811E+00 2.91248E-02 9159.404 168.224 6.750 1.04146E+00 1.01823E+00 2.28145E-02 9161.976 170.798 6.800 1.03396E+00 1.01831E+00 1.53643E-02 9164.549 173.372 6.850 1.02718E+00 1.01832E+00 8.69667E-03 9167.242 176.065 6.900 1.02188E+00 1.01800E+00 3.81782E-03 9169.949 178.772 6.950 1.01837E+00 1.01755E+00 8.08013E-04 9172.656 181.479 7.000 1.01580E+00 1.01708E+00 -1.25663E-03 9175.363 184.186 7.050 1.01301E+00 1.01660E+00 -3.52424E-03 9178.070 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