92 lines
8.9 KiB
Plaintext
92 lines
8.9 KiB
Plaintext
89
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -4.33500 37.07506 0.59541 -0.0040 -0.0040 -0.0040 -2.9247
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Ag -2.19654 40.92713 3.46670 -0.0024 -0.0024 -0.0024 -2.8916
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Ag -4.50058 40.61195 5.08746 -0.0028 -0.0028 -0.0028 -2.8833
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Ag -4.84972 35.69207 -2.09693 0.0001 0.0001 0.0001 -2.9152
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Ag -8.03184 35.90575 1.65640 0.0001 0.0001 0.0001 -2.8763
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Ag -3.82031 38.50437 3.11394 -0.0004 -0.0004 -0.0004 -2.9098
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Ag -3.34149 34.60529 1.67126 -0.0007 -0.0007 -0.0007 -2.8993
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Ag -7.01806 37.04251 -0.75019 0.0025 0.0025 0.0025 -2.8885
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Ag -5.94023 34.49327 0.29174 -0.0040 -0.0040 -0.0040 -2.8744
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Ag -5.89437 38.10247 -3.03962 0.0000 0.0000 0.0000 -2.8359
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Ag -2.19130 35.76705 -0.80486 -0.0003 -0.0003 -0.0003 -2.8466
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Ag -6.05848 38.24753 4.87898 0.0007 0.0007 0.0007 -2.8668
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Ag -6.96158 33.63529 2.77376 -0.0011 -0.0011 -0.0011 -2.5672
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Ag -4.15562 41.40950 7.84567 0.0025 0.0025 0.0025 -2.3582
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Ag -4.23637 37.39751 8.53425 0.0013 0.0013 0.0013 -2.2964
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Ag -1.78675 37.03226 1.78594 -0.0000 -0.0000 -0.0000 -2.9281
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Ag -7.36609 32.24008 0.09388 -0.0000 -0.0000 -0.0000 -2.4495
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Ag -7.84837 39.67117 -1.41246 -0.0000 -0.0000 -0.0000 -2.5663
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Ag -5.22067 36.24838 3.19726 0.0023 0.0023 0.0023 -2.8303
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Ag -10.58091 35.88340 0.41511 0.0012 0.0012 0.0012 -2.4826
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Ag -0.82719 33.61397 0.47909 -0.0007 -0.0007 -0.0007 -2.6078
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Ag -0.15408 42.52364 2.53247 0.0012 0.0012 0.0012 -2.3069
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Ag -0.98916 36.93253 -3.17171 0.0004 0.0004 0.0004 -2.4888
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Ag -0.66185 40.86332 -0.47878 0.0000 0.0000 0.0000 -2.4175
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Ag -4.55554 33.64253 4.01757 0.0023 0.0023 0.0023 -2.5906
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Ag -3.24580 40.99579 -1.65899 0.0001 0.0001 0.0001 -2.6693
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Ag -5.35596 39.42559 -0.51117 0.0011 0.0011 0.0011 -2.8775
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Ag -9.27796 38.20347 0.49137 -0.0013 -0.0013 -0.0013 -2.7009
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Ag -1.12199 38.43951 4.46837 0.0023 0.0023 0.0023 -2.8090
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Ag -2.52922 39.47132 8.68711 0.0022 0.0022 0.0022 -2.2424
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Ag -4.86976 40.93074 2.06977 -0.0024 -0.0024 -0.0024 -2.8439
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Ag -6.37834 39.72294 -5.33147 0.0028 0.0028 0.0028 -2.2334
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Ag -0.19260 39.29784 1.85140 0.0002 0.0002 0.0002 -2.6273
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Ag -3.20738 43.03104 5.91192 0.0000 0.0000 0.0000 -2.4365
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Ag -2.61557 39.68214 0.90780 0.0011 0.0011 0.0011 -2.8011
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Ag -2.76217 43.56767 3.24611 0.0003 0.0003 0.0003 -2.4127
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Ag -6.49909 38.45645 1.87270 0.0003 0.0003 0.0003 -2.9226
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Ag -8.39355 39.24871 5.89296 -0.0006 -0.0006 -0.0006 -2.5480
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Ag -1.96901 40.45361 6.18319 -0.0005 -0.0005 -0.0005 -2.7249
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Ag -10.19308 35.49233 3.21148 0.0009 0.0009 0.0009 -2.4974
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Ag -0.70321 38.09222 -0.69970 -0.0017 -0.0017 -0.0017 -2.6919
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Ag -9.53921 36.96569 -2.01979 -0.0021 -0.0021 -0.0021 -2.4515
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Ag -8.35962 34.72493 -0.84126 -0.0027 -0.0027 -0.0027 -2.6512
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Ag 0.46499 35.89462 0.53576 0.0033 0.0033 0.0033 -2.4621
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Ag -6.29664 33.27100 -2.28630 -0.0022 -0.0022 -0.0022 -2.6567
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Ag -8.34343 38.35292 -4.04831 -0.0013 -0.0013 -0.0013 -2.3628
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Ag -5.76271 39.36757 7.46351 0.0006 0.0006 0.0006 -2.5805
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Ag -0.02262 34.58738 -2.03224 0.0012 0.0012 0.0012 -2.3923
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Ag 0.73960 36.95132 3.12782 0.0008 0.0008 0.0008 -2.4039
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Ag -9.75191 36.92952 5.71711 -0.0014 -0.0014 -0.0014 -2.3801
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Ag -8.71679 37.97173 3.40769 -0.0002 -0.0002 -0.0002 -2.8601
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Ag -7.62878 35.57509 4.56426 0.0015 0.0015 0.0015 -2.6798
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Ag -5.04046 32.02298 1.37493 -0.0036 -0.0036 -0.0036 -2.5466
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Ag -11.29378 37.81391 2.28705 -0.0004 -0.0004 -0.0004 -2.3864
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Ag -0.34411 35.82853 5.41980 -0.0012 -0.0012 -0.0012 -2.4827
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Ag -3.51669 37.01478 -4.29673 -0.0008 -0.0008 -0.0008 -2.6067
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Ag -2.53256 34.55330 -3.34288 -0.0017 -0.0017 -0.0017 -2.6764
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Ag -0.69223 34.57844 3.00647 0.0037 0.0037 0.0037 -2.6466
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Ag -7.14594 40.65301 3.77941 -0.0031 -0.0031 -0.0031 -2.7387
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Ag -5.35754 43.01326 4.06778 0.0002 0.0002 0.0002 -2.3794
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Ag -5.88378 40.95957 -2.84123 0.0028 0.0028 0.0028 -2.5063
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Ag -2.52469 35.73588 7.12065 0.0002 0.0002 0.0002 -2.4937
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Ag -10.80407 39.33479 4.69257 0.0013 0.0013 0.0013 -2.2466
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Ag -2.77676 42.28459 0.69625 -0.0001 -0.0001 -0.0001 -2.5152
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Ag -5.06786 34.61015 -4.48590 0.0019 0.0019 0.0019 -2.4742
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Ag -3.75007 39.77307 -4.10728 0.0020 0.0020 0.0020 -2.5063
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Ag -6.07734 37.04487 -5.44281 -0.0005 -0.0005 -0.0005 -2.3724
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Ag -9.71967 40.28722 2.39922 0.0056 0.0056 0.0056 -2.3838
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Ag -2.79976 35.99651 4.22657 -0.0022 -0.0022 -0.0022 -2.8611
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Ag -2.00659 33.70751 5.37806 0.0039 0.0039 0.0039 -2.3892
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Ag -2.34982 32.36108 2.89532 -0.0019 -0.0019 -0.0019 -2.4473
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Ag -3.64997 37.97999 5.92262 0.0013 0.0013 0.0013 -2.8582
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Ag 0.35849 40.66887 4.47679 -0.0010 -0.0010 -0.0010 -2.3668
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Ag -4.82940 31.16466 -1.00717 0.0011 0.0011 0.0011 -2.3655
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Ag -3.49503 33.53940 -0.73923 -0.0020 -0.0020 -0.0020 -2.7876
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Ag -7.50488 35.61672 -3.44867 -0.0015 -0.0015 -0.0015 -2.6387
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Ag -1.15462 39.73768 -2.88201 0.0028 0.0028 0.0028 -2.3856
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Ag -9.57362 33.46220 1.28589 -0.0016 -0.0016 -0.0016 -2.3478
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Ag -7.39251 40.97740 1.03765 0.0008 0.0008 0.0008 -2.5446
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Ag -3.27376 38.18774 -1.83098 0.0011 0.0011 0.0011 -2.8975
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Ag -0.87761 38.01046 7.18604 0.0019 0.0019 0.0019 -2.3883
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Ag -2.37960 31.24936 0.33660 0.0000 0.0000 0.0000 -2.3799
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Ag -0.63564 43.13656 5.16615 0.0018 0.0018 0.0018 -2.2607
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Ag -5.33608 42.28246 -0.30250 0.0023 0.0023 0.0023 -2.3934
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Ag -3.98918 32.21662 -3.39581 -0.0003 -0.0003 -0.0003 -2.3649
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Ag -7.31019 36.92011 7.13409 0.0016 0.0016 0.0016 -2.4063
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Ag -1.46313 32.23152 -2.08151 0.0013 0.0013 0.0013 -2.3867
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Ag -6.57456 41.80360 6.36369 -0.0022 -0.0022 -0.0022 -2.3535
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Ag -5.13112 35.61452 5.96544 0.0009 0.0009 0.0009 -2.6681
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