87 lines
8.4 KiB
Plaintext
87 lines
8.4 KiB
Plaintext
84
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -0.87593 12.07742 6.78088 -0.0005 -0.0005 -0.0005 -2.8903
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Ag -1.06742 7.85411 6.44298 -0.0009 -0.0009 -0.0009 -2.9256
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Ag -4.73957 10.03536 9.11524 -0.0002 -0.0002 -0.0002 -2.8592
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Ag -0.87994 14.98922 6.10538 0.0049 0.0049 0.0049 -2.8227
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Ag -1.86085 14.09566 8.55466 0.0004 0.0004 0.0004 -2.8658
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Ag -2.03826 9.87886 8.33570 -0.0023 -0.0023 -0.0023 -2.9073
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Ag -5.50973 12.88768 5.56072 0.0007 0.0007 0.0007 -2.8809
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Ag 0.78545 13.89690 7.87029 0.0008 0.0008 0.0008 -2.8303
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Ag -3.76681 14.75863 6.55527 -0.0007 -0.0007 -0.0007 -2.8923
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Ag 1.73165 14.71763 5.35005 0.0039 0.0039 0.0039 -2.8449
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Ag -2.87510 12.71455 4.67359 0.0006 0.0006 0.0006 -2.9220
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Ag -3.04343 11.90334 10.13228 -0.0014 -0.0014 -0.0014 -2.8857
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Ag -4.41758 14.31515 9.43876 0.0012 0.0012 0.0012 -2.7428
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Ag -2.05748 6.86511 8.91391 0.0004 0.0004 0.0004 -2.5825
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Ag -5.46627 9.36051 11.67278 0.0024 0.0024 0.0024 -2.3440
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Ag -2.87872 9.80524 5.33329 -0.0006 -0.0006 -0.0006 -2.8541
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Ag -4.52218 16.86636 8.34756 0.0009 0.0009 0.0009 -2.3759
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Ag 3.61838 14.17743 7.43684 0.0005 0.0005 0.0005 -2.5441
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Ag -3.64763 12.07464 7.39786 -0.0006 -0.0006 -0.0006 -2.9002
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Ag 0.38708 16.64650 10.10688 0.0012 0.0012 0.0012 -2.3194
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Ag -6.32355 12.80247 2.70396 -0.0013 -0.0013 -0.0013 -2.3472
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Ag -0.24139 5.80650 4.44653 0.0001 0.0001 0.0001 -2.2672
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Ag -0.89731 12.69236 1.34109 -0.0001 -0.0001 -0.0001 -2.2856
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Ag 1.34947 8.32076 3.22191 -0.0020 -0.0020 -0.0020 -2.3050
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Ag -6.25420 12.30099 8.31546 -0.0023 -0.0023 -0.0023 -2.7449
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Ag 3.07577 10.14594 4.26359 -0.0029 -0.0029 -0.0029 -2.4779
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Ag 1.92433 11.97513 6.03274 -0.0011 -0.0011 -0.0011 -2.9086
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Ag 1.47738 13.98192 10.71291 0.0006 0.0006 0.0006 -2.6477
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Ag -3.85362 7.90174 7.14524 0.0011 0.0011 0.0011 -2.8942
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Ag -4.59168 7.31975 9.81864 -0.0009 -0.0009 -0.0009 -2.4815
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Ag 0.66735 9.87473 7.58107 -0.0040 -0.0040 -0.0040 -2.8969
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Ag 4.50154 14.79184 4.83496 -0.0012 -0.0012 -0.0012 -2.3548
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Ag -1.60833 8.00592 3.66979 -0.0003 -0.0003 -0.0003 -2.5805
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Ag -0.91372 5.17489 7.12622 -0.0013 -0.0013 -0.0013 -2.3776
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Ag 0.05163 9.99790 4.83977 -0.0011 -0.0011 -0.0011 -2.8925
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Ag 0.86346 7.07336 8.39159 -0.0021 -0.0021 -0.0021 -2.4743
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Ag -0.20534 11.91727 9.50118 0.0031 0.0031 0.0031 -2.8810
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Ag -0.99580 11.04266 12.15560 0.0027 0.0027 0.0027 -2.5951
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Ag -3.72072 5.20951 7.76836 -0.0023 -0.0023 -0.0023 -2.3361
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Ag -1.85228 13.97382 13.93029 0.0010 0.0010 0.0010 -2.2384
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Ag -1.85041 10.70891 2.86788 -0.0019 -0.0019 -0.0019 -2.6491
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Ag 2.60210 15.93461 9.01980 -0.0047 -0.0047 -0.0047 -2.3136
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Ag -1.85608 16.89212 7.80095 0.0002 0.0002 0.0002 -2.5458
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Ag -4.72021 10.71219 3.53752 0.0006 0.0006 0.0006 -2.6682
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Ag -2.74211 16.80110 4.95704 -0.0006 -0.0006 -0.0006 -2.4876
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Ag 3.70943 16.92889 6.70741 -0.0004 -0.0004 -0.0004 -2.2523
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Ag -2.79423 9.15420 11.00842 -0.0005 -0.0005 -0.0005 -2.6344
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Ag -3.57876 12.78931 1.97353 0.0001 0.0001 0.0001 -2.4477
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Ag -4.58492 7.86572 4.23816 -0.0000 -0.0000 -0.0000 -2.5525
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Ag -3.57900 11.52546 12.83578 -0.0013 -0.0013 -0.0013 -2.4388
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Ag -1.35917 13.65017 11.24136 -0.0003 -0.0003 -0.0003 -2.7318
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Ag -3.97058 14.13241 12.07908 -0.0024 -0.0024 -0.0024 -2.4673
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Ag -6.30689 15.02230 7.50031 0.0005 0.0005 0.0005 -2.5312
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Ag -0.30097 15.72790 12.45030 0.0013 0.0013 0.0013 -2.2945
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Ag -7.11528 8.17721 5.18584 -0.0009 -0.0009 -0.0009 -2.3977
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Ag 1.14536 14.72453 2.60776 0.0025 0.0025 0.0025 -2.4906
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Ag -1.62218 14.90220 3.25355 0.0018 0.0018 0.0018 -2.6605
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Ag -7.48085 10.81942 4.34248 -0.0011 -0.0011 -0.0011 -2.4524
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Ag -0.25169 8.92726 10.09613 0.0014 0.0014 0.0014 -2.6307
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Ag 2.48009 8.99368 9.37383 -0.0028 -0.0028 -0.0028 -2.3786
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Ag 4.84890 12.31087 6.05593 -0.0018 -0.0018 -0.0018 -2.2672
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Ag -7.33403 10.17123 9.81027 -0.0022 -0.0022 -0.0022 -2.3518
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Ag 0.57605 12.99320 13.10593 -0.0026 -0.0026 -0.0026 -2.3596
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Ag 1.66449 7.77722 5.78453 0.0007 0.0007 0.0007 -2.5614
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Ag 0.15637 16.79882 4.33732 -0.0001 -0.0001 -0.0001 -2.4897
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Ag 3.06656 12.89881 3.73536 -0.0003 -0.0003 -0.0003 -2.5520
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Ag 2.86422 16.66969 3.86028 0.0015 0.0015 0.0015 -2.2566
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Ag 1.59742 11.02700 11.21848 0.0002 0.0002 0.0002 -2.4557
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Ag -5.46863 10.04993 6.28908 -0.0017 -0.0017 -0.0017 -2.9009
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Ag -8.17838 10.07118 6.96545 -0.0033 -0.0033 -0.0033 -2.4345
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Ag -8.17168 12.86138 6.35498 -0.0014 -0.0014 -0.0014 -2.3455
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Ag -5.62648 12.20493 11.08732 -0.0001 -0.0001 -0.0001 -2.5543
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Ag -5.74859 5.88080 5.82370 -0.0002 -0.0002 -0.0002 -2.2614
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Ag -5.41558 16.80355 5.63937 0.0010 0.0010 0.0010 -2.3633
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Ag -4.48018 14.88483 3.81348 0.0023 0.0023 0.0023 -2.6717
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Ag 0.89147 16.81290 7.09851 -0.0018 -0.0018 -0.0018 -2.5971
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Ag 1.15739 11.12769 2.54229 0.0008 0.0008 0.0008 -2.5113
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Ag -2.57376 16.09977 10.48124 0.0004 0.0004 0.0004 -2.5457
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Ag 2.54369 11.82208 8.76909 -0.0005 -0.0005 -0.0005 -2.6947
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Ag -0.03734 12.85668 4.23169 -0.0015 -0.0015 -0.0015 -2.8644
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Ag -6.50891 8.03348 7.96404 -0.0019 -0.0019 -0.0019 -2.5775
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Ag -7.29394 14.71358 4.53429 -0.0021 -0.0021 -0.0021 -2.3215
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Ag -2.84236 5.94129 5.25663 -0.0005 -0.0005 -0.0005 -2.5860
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Ag 3.37382 9.76030 6.87265 0.0036 0.0036 0.0036 -2.4691
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