37 lines
3.4 KiB
Plaintext
37 lines
3.4 KiB
Plaintext
34
|
|
Ag Ag pos(A), vel, pot-en(eV)
|
|
Ag -10.58641 -4.03779 23.95897 -0.0022 -0.0022 -0.0022 -2.9170
|
|
Ag -12.32698 -5.96483 24.96468 0.0012 0.0012 0.0012 -2.4449
|
|
Ag -10.06451 -5.29729 21.28927 -0.0003 -0.0003 -0.0003 -2.2816
|
|
Ag -8.17578 -3.02806 22.76796 -0.0009 -0.0009 -0.0009 -2.4071
|
|
Ag -9.83015 -1.34718 24.13162 -0.0001 -0.0001 -0.0001 -2.5914
|
|
Ag -13.20645 -3.52840 25.37976 0.0002 0.0002 0.0002 -2.4691
|
|
Ag -6.56848 -3.31360 30.18382 -0.0001 -0.0001 -0.0001 -2.2776
|
|
Ag -12.42860 -1.99122 23.34119 0.0007 0.0007 0.0007 -2.3477
|
|
Ag -10.96774 -8.20181 25.98238 0.0014 0.0014 0.0014 -2.2547
|
|
Ag -8.29518 -3.30543 25.53372 0.0026 0.0026 0.0026 -2.8190
|
|
Ag -8.48894 -4.52712 27.96283 0.0014 0.0014 0.0014 -2.8275
|
|
Ag -5.64188 -3.48474 25.41895 -0.0009 -0.0009 -0.0009 -2.2766
|
|
Ag -9.04951 -2.31630 29.24047 0.0024 0.0024 0.0024 -2.5187
|
|
Ag -12.01949 -1.04198 25.87044 0.0000 0.0000 0.0000 -2.4576
|
|
Ag -8.43084 -5.76601 23.37132 -0.0009 -0.0009 -0.0009 -2.5144
|
|
Ag -5.55823 -4.52576 27.92742 -0.0041 -0.0041 -0.0041 -2.3743
|
|
Ag -12.39212 -5.32305 27.52570 0.0018 0.0018 0.0018 -2.4158
|
|
Ag -6.97954 -1.03251 25.00645 0.0009 0.0009 0.0009 -2.2735
|
|
Ag -10.90404 -3.37446 26.65652 -0.0022 -0.0022 -0.0022 -2.8264
|
|
Ag -9.13808 -0.82061 26.82293 -0.0016 -0.0016 -0.0016 -2.5395
|
|
Ag -8.38594 -7.91901 24.97910 0.0014 0.0014 0.0014 -2.3103
|
|
Ag -10.65169 -7.11480 23.27638 0.0031 0.0031 0.0031 -2.4479
|
|
Ag -6.79974 -2.14210 27.57732 -0.0011 -0.0011 -0.0011 -2.5697
|
|
Ag -9.90073 -5.87848 25.92832 -0.0005 -0.0005 -0.0005 -2.7935
|
|
Ag -7.05750 -5.96278 26.02518 0.0006 0.0006 0.0006 -2.5768
|
|
Ag -12.57897 -4.85994 22.26322 0.0018 0.0018 0.0018 -2.2974
|
|
Ag -11.39114 -3.97207 29.41423 -0.0018 -0.0018 -0.0018 -2.4420
|
|
Ag -10.65847 -2.70136 21.49653 -0.0028 -0.0028 -0.0028 -2.3082
|
|
Ag -6.99328 -6.16579 29.45517 0.0012 0.0012 0.0012 -2.3349
|
|
Ag -10.25964 -6.39022 28.91783 0.0034 0.0034 0.0034 -2.4657
|
|
Ag -8.83510 -4.63641 30.74767 0.0019 0.0019 0.0019 -2.3429
|
|
Ag -11.17780 -0.82473 28.69315 -0.0025 -0.0025 -0.0025 -2.2126
|
|
Ag -8.38397 -7.76983 27.62368 0.0021 0.0021 0.0021 -2.3786
|
|
Ag -13.22595 -2.59884 27.96116 -0.0022 -0.0022 -0.0022 -2.3491
|