Cu crystal, 4 shells Feff 6.01 potph 4.12 Abs Z=29 Rmt= 1.289 Rnm= 1.427 K shell Pot 1 Z=29 Rmt= 1.275 Rnm= 1.399 Gam_ch=1.761E+00 H-L exch Mu=-5.493E+00 kf=1.793E+00 Vint=-1.774E+01 Rs_int= 2.023 Path 14 icalc 2 Feff 6.01 genfmt 1.44 ------------------------------------------------------------------------------- 4 12.000 5.1053 2.6440 -5.49271 nleg, deg, reff, rnrmav(bohr), edge x y z pot at# 0.0000 0.0000 0.0000 0 29 absorbing atom 0.0000 -1.8050 1.8050 1 29 0.0000 0.0000 0.0000 0 29 0.0000 -1.8050 1.8050 1 29 k real[2*phc] mag[feff] phase[feff] red factor lambda real[p]@# -1.400 3.2986E+00 7.1640E-02 -5.0119E+00 0.9656E+00 9.7317E+00 1.1247E+00 -1.200 3.3755E+00 8.1902E-02 -6.7211E+00 0.9689E+00 1.1550E+01 1.3348E+00 -1.000 3.4322E+00 3.4137E-01 -6.9279E+00 0.9737E+00 1.2894E+01 1.4901E+00 -0.800 3.4710E+00 2.1018E-01 -7.0613E+00 0.9781E+00 1.3897E+01 1.6061E+00 -0.600 3.4961E+00 1.0755E-01 -8.1827E+00 0.9816E+00 1.4631E+01 1.6908E+00 -0.400 3.5114E+00 5.7800E-02 -9.6994E+00 0.9841E+00 1.5133E+01 1.7489E+00 -0.200 3.5195E+00 2.5934E-02 -1.1453E+01 0.9856E+00 1.5427E+01 1.7828E+00 0.000 3.5221E+00 0.0000E+00 -1.3402E+01 0.9860E+00 1.5524E+01 1.7940E+00 0.200 3.5243E+00 2.4327E-02 -1.5356E+01 0.9865E+00 1.5614E+01 1.8047E+00 0.400 3.5307E+00 4.4673E-02 -1.7139E+01 0.9880E+00 1.5852E+01 1.8364E+00 0.600 3.5396E+00 5.9238E-02 -1.8764E+01 0.9906E+00 1.6149E+01 1.8881E+00 0.800 3.5489E+00 6.8369E-02 -2.0242E+01 0.9946E+00 1.6372E+01 1.9584E+00 1.000 3.5551E+00 7.3080E-02 -2.1579E+01 0.1000E+01 1.6385E+01 2.0460E+00 1.200 3.5541E+00 7.3965E-02 -2.2778E+01 0.1008E+01 1.6104E+01 2.1497E+00 1.400 3.5409E+00 7.1077E-02 -2.3841E+01 0.1019E+01 1.5535E+01 2.2685E+00 1.600 3.5105E+00 6.4349E-02 -2.4766E+01 0.1031E+01 1.4784E+01 2.4020E+00 1.800 3.4577E+00 5.4164E-02 -2.5550E+01 0.1044E+01 1.4017E+01 2.5500E+00 2.000 3.3781E+00 4.1697E-02 -2.6181E+01 0.1054E+01 1.3417E+01 2.7128E+00 2.200 3.0569E+00 2.1528E-02 -2.6206E+01 0.1053E+01 1.3506E+01 2.9674E+00 2.400 3.1624E+00 2.1774E-02 -2.7148E+01 0.1240E+01 7.3853E+00 3.0785E+00 2.600 3.1827E+00 1.7648E-02 -2.7859E+01 0.1309E+01 6.0822E+00 3.2099E+00 2.800 3.1766E+00 1.2169E-02 -2.8400E+01 0.1330E+01 5.5792E+00 3.3492E+00 3.000 3.1354E+00 7.9418E-03 -2.8694E+01 0.1323E+01 5.3778E+00 3.4958E+00 3.200 3.0736E+00 5.7376E-03 -2.8837E+01 0.1306E+01 5.3287E+00 3.6488E+00 3.400 3.0058E+00 6.2049E-03 -2.9136E+01 0.1282E+01 5.3706E+00 3.8076E+00 3.600 2.9211E+00 9.3312E-03 -2.9695E+01 0.1256E+01 5.4731E+00 3.9715E+00 3.800 2.8375E+00 1.6325E-02 -3.0215E+01 0.1229E+01 5.6194E+00 4.1397E+00 4.000 2.7420E+00 2.8083E-02 -3.0616E+01 0.1204E+01 5.7992E+00 4.3116E+00 4.200 2.6523E+00 4.3950E-02 -3.0924E+01 0.1178E+01 6.0058E+00 4.4868E+00 4.400 2.5479E+00 6.3951E-02 -3.1180E+01 0.1155E+01 6.2347E+00 4.6649E+00 4.600 2.4499E+00 8.6287E-02 -3.1407E+01 0.1133E+01 6.4825E+00 4.8454E+00 4.800 2.3543E+00 1.1192E-01 -3.1591E+01 0.1113E+01 6.7469E+00 5.0280E+00 5.000 2.2578E+00 1.3649E-01 -3.1777E+01 0.1094E+01 7.0260E+00 5.2125E+00 5.200 2.1569E+00 1.6263E-01 -3.1942E+01 0.1077E+01 7.3184E+00 5.3985E+00 5.400 2.0604E+00 1.8974E-01 -3.2085E+01 0.1063E+01 7.6231E+00 5.5860E+00 5.600 1.9615E+00 2.1333E-01 -3.2235E+01 0.1048E+01 7.9389E+00 5.7746E+00 5.800 1.8680E+00 2.3736E-01 -3.2367E+01 0.1036E+01 8.2654E+00 5.9644E+00 6.000 1.7714E+00 2.5754E-01 -3.2494E+01 0.1025E+01 8.6017E+00 6.1550E+00 6.500 1.5359E+00 2.8922E-01 -3.2799E+01 0.1002E+01 9.4825E+00 6.6352E+00 7.000 1.3073E+00 2.9136E-01 -3.3084E+01 0.9843E+00 1.0416E+01 7.1192E+00 7.500 1.0893E+00 2.6931E-01 -3.3359E+01 0.9694E+00 1.1397E+01 7.6061E+00 8.000 8.8382E-01 2.3523E-01 -3.3620E+01 0.9565E+00 1.2422E+01 8.0952E+00 8.500 6.8950E-01 1.9768E-01 -3.3865E+01 0.9456E+00 1.3489E+01 8.5862E+00 9.000 5.0373E-01 1.5995E-01 -3.4117E+01 0.9368E+00 1.4595E+01 9.0785E+00 9.500 3.2768E-01 1.2523E-01 -3.4385E+01 0.9292E+00 1.5739E+01 9.5719E+00 10.000 1.5323E-01 9.5837E-02 -3.4675E+01 0.9211E+00 1.6919E+01 1.0066E+01 11.000 -1.7458E-01 5.5187E-02 -3.5249E+01 0.9045E+00 1.9382E+01 1.1057E+01 12.000 -4.7911E-01 3.1350E-02 -3.5846E+01 0.8926E+00 2.1974E+01 1.2050E+01 13.000 -7.6274E-01 1.8134E-02 -3.6473E+01 0.8869E+00 2.4688E+01 1.3044E+01 14.000 -1.0214E+00 1.0646E-02 -3.7052E+01 0.8820E+00 2.7517E+01 1.4039E+01 15.000 -1.2620E+00 6.4367E-03 -3.7678E+01 0.8790E+00 3.0456E+01 1.5036E+01 16.000 -1.4864E+00 3.9972E-03 -3.8240E+01 0.8783E+00 3.3499E+01 1.6032E+01 17.000 -1.6920E+00 2.5075E-03 -3.8820E+01 0.8766E+00 3.6643E+01 1.7030E+01 18.000 -1.8866E+00 1.6631E-03 -3.9396E+01 0.8763E+00 3.9882E+01 1.8027E+01 19.000 -2.0662E+00 1.0310E-03 -3.9916E+01 0.8760E+00 4.3213E+01 1.9025E+01 20.000 -2.2311E+00 4.5184E-04 -4.0885E+01 0.8745E+00 4.6633E+01 2.0024E+01