75 lines
7.2 KiB
Plaintext
75 lines
7.2 KiB
Plaintext
72
|
|
Ag Ag pos(A), vel, pot-en(eV)
|
|
Ag 3.68339 3.22683 -1.32143 -0.0021 -0.0021 -0.0021 -2.5496
|
|
Ag 0.83214 -5.30671 -2.77481 0.0013 0.0013 0.0013 -2.3257
|
|
Ag 1.46753 -1.11000 6.08985 0.0002 0.0002 0.0002 -2.3611
|
|
Ag 1.99745 1.62598 5.39158 -0.0021 -0.0021 -0.0021 -2.3301
|
|
Ag -1.23975 2.53504 3.33247 0.0007 0.0007 0.0007 -2.7015
|
|
Ag -1.71849 -0.27426 2.46812 -0.0007 -0.0007 -0.0007 -2.9561
|
|
Ag -1.16182 6.10684 -0.66122 -0.0023 -0.0023 -0.0023 -2.3802
|
|
Ag -1.51675 0.90182 -1.87812 -0.0014 -0.0014 -0.0014 -2.8598
|
|
Ag 3.17666 1.25994 -3.40261 -0.0009 -0.0009 -0.0009 -2.6412
|
|
Ag -1.02143 0.73483 -5.86985 0.0003 0.0003 0.0003 -2.3713
|
|
Ag 4.55013 0.38128 -1.30183 0.0003 0.0003 0.0003 -2.5348
|
|
Ag -4.38949 -0.34301 -2.38252 -0.0034 -0.0034 -0.0034 -2.5489
|
|
Ag -3.20679 -2.93598 -2.11183 0.0007 0.0007 0.0007 -2.5667
|
|
Ag -2.10989 -1.03082 -3.96973 -0.0038 -0.0038 -0.0038 -2.6937
|
|
Ag 0.28279 3.03942 0.97230 0.0007 0.0007 0.0007 -2.8339
|
|
Ag 1.06996 4.60375 -1.16085 -0.0027 -0.0027 -0.0027 -2.6270
|
|
Ag -0.36655 -2.06117 -5.85350 0.0018 0.0018 0.0018 -2.2864
|
|
Ag -2.79447 -0.98286 -0.17179 -0.0005 -0.0005 -0.0005 -2.9006
|
|
Ag -1.60757 3.44440 -1.52268 -0.0010 -0.0010 -0.0010 -2.7966
|
|
Ag 2.46499 -0.71286 -5.42891 -0.0007 -0.0007 -0.0007 -2.3403
|
|
Ag -2.44215 1.73321 0.59108 -0.0017 -0.0017 -0.0017 -2.9019
|
|
Ag -0.53313 -1.86507 -1.83528 0.0033 0.0033 0.0033 -2.9028
|
|
Ag 0.55664 5.53254 1.56852 0.0005 0.0005 0.0005 -2.3451
|
|
Ag 1.60185 -3.30093 -0.68310 0.0015 0.0015 0.0015 -2.8852
|
|
Ag 4.32495 -2.19651 -0.35550 0.0012 0.0012 0.0012 -2.6481
|
|
Ag -0.45572 -2.39751 1.04424 0.0006 0.0006 0.0006 -2.9271
|
|
Ag -0.49663 5.38172 -3.19909 0.0002 0.0002 0.0002 -2.3550
|
|
Ag 0.15451 -4.35706 4.40360 -0.0018 -0.0018 -0.0018 -2.3826
|
|
Ag -3.08437 -3.48635 0.79387 0.0013 0.0013 0.0013 -2.5658
|
|
Ag -3.12885 -0.66815 4.88514 0.0008 0.0008 0.0008 -2.3988
|
|
Ag -4.18353 2.34771 -1.70035 0.0014 0.0014 0.0014 -2.6561
|
|
Ag 0.94601 -6.01746 -0.06185 -0.0028 -0.0028 -0.0028 -2.3590
|
|
Ag -2.15617 -3.00963 3.24455 -0.0023 -0.0023 -0.0023 -2.6430
|
|
Ag 2.08900 -0.70455 -1.54300 0.0030 0.0030 0.0030 -2.9059
|
|
Ag 1.86711 3.78266 -3.67382 -0.0001 -0.0001 -0.0001 -2.4643
|
|
Ag -3.23827 1.48478 -4.22796 -0.0005 -0.0005 -0.0005 -2.4862
|
|
Ag -3.88502 1.42373 2.96523 0.0022 0.0022 0.0022 -2.5806
|
|
Ag 5.33881 2.57955 0.92549 0.0003 0.0003 0.0003 -2.2757
|
|
Ag 4.27575 -2.80764 2.40597 0.0007 0.0007 0.0007 -2.4547
|
|
Ag 4.84610 -0.09317 1.61257 0.0002 0.0002 0.0002 -2.5653
|
|
Ag -0.63399 0.34952 5.08408 -0.0008 -0.0008 -0.0008 -2.6753
|
|
Ag 2.93397 4.13957 1.21541 -0.0028 -0.0028 -0.0028 -2.5663
|
|
Ag 3.59743 -4.88079 0.33891 -0.0020 -0.0020 -0.0020 -2.3553
|
|
Ag 3.20915 -0.52320 3.91138 0.0001 0.0001 0.0001 -2.6722
|
|
Ag -4.36296 -1.41103 2.12401 0.0004 0.0004 0.0004 -2.5340
|
|
Ag 1.36277 -2.77902 -3.73132 -0.0003 -0.0003 -0.0003 -2.7362
|
|
Ag 1.43832 1.81331 -5.65350 -0.0005 -0.0005 -0.0005 -2.3665
|
|
Ag -2.01687 4.51981 1.44151 -0.0018 -0.0018 -0.0018 -2.5765
|
|
Ag -3.17863 4.09885 -3.63934 -0.0023 -0.0023 -0.0023 -2.3344
|
|
Ag -0.85798 -5.00820 1.86081 0.0023 0.0023 0.0023 -2.4873
|
|
Ag 0.48718 -0.02097 -3.74930 -0.0017 -0.0017 -0.0017 -2.8833
|
|
Ag -4.99846 0.64797 0.38667 0.0029 0.0029 0.0029 -2.5623
|
|
Ag 2.24456 -1.31559 1.30749 -0.0003 -0.0003 -0.0003 -2.9439
|
|
Ag 1.64241 -4.10117 2.05096 -0.0007 -0.0007 -0.0007 -2.7403
|
|
Ag -0.98074 -4.32814 -0.85591 0.0005 0.0005 0.0005 -2.6502
|
|
Ag -0.74339 2.60535 -4.06696 -0.0029 -0.0029 -0.0029 -2.7338
|
|
Ag 3.94865 -1.61310 -3.34298 0.0012 0.0012 0.0012 -2.4531
|
|
Ag 0.95576 0.86164 2.77047 -0.0013 -0.0013 -0.0013 -2.9001
|
|
Ag 2.74976 1.48202 0.63558 0.0036 0.0036 0.0036 -2.8792
|
|
Ag 2.68726 -3.20572 4.64661 -0.0012 -0.0012 -0.0012 -2.3736
|
|
Ag -4.59148 3.37884 1.05828 0.0024 0.0024 0.0024 -2.3606
|
|
Ag 1.32781 3.55670 3.41536 0.0007 0.0007 0.0007 -2.5123
|
|
Ag 3.58101 1.99547 3.04999 -0.0015 -0.0015 -0.0015 -2.5556
|
|
Ag 0.14892 0.26388 0.29144 0.0003 0.0003 0.0003 -2.8887
|
|
Ag -1.25199 -2.43476 5.70716 -0.0002 -0.0002 -0.0002 -2.3454
|
|
Ag 3.66269 -4.04070 -2.27851 0.0001 0.0001 0.0001 -2.3401
|
|
Ag -1.22422 -3.80406 -3.88493 -0.0011 -0.0011 -0.0011 -2.4515
|
|
Ag -2.93543 1.80228 5.43855 -0.0019 -0.0019 -0.0019 -2.0955
|
|
Ag -3.60903 5.13196 -0.81499 0.0011 0.0011 0.0011 -2.3509
|
|
Ag -5.40701 -2.23463 -0.57956 -0.0009 -0.0009 -0.0009 -2.2596
|
|
Ag 0.56149 -1.76842 3.59921 0.0006 0.0006 0.0006 -2.8999
|
|
Ag 1.15366 2.04764 -1.64991 0.0017 0.0017 0.0017 -2.8783
|