83 lines
8.0 KiB
Plaintext
83 lines
8.0 KiB
Plaintext
80
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Ag Ag pos(A), vel, pot-en(eV)
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Ag 9.66653 0.53163 4.50236 -0.0029 -0.0029 -0.0029 -2.8602
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Ag 11.31964 -0.32043 2.55368 -0.0021 -0.0021 -0.0021 -2.9126
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Ag 10.02083 4.31226 0.53724 0.0001 0.0001 0.0001 -2.9058
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Ag 10.91240 2.00497 6.51277 0.0018 0.0018 0.0018 -2.9485
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Ag 8.85786 3.41440 5.07199 -0.0008 -0.0008 -0.0008 -2.9243
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Ag 8.71116 1.14110 2.00865 -0.0005 -0.0005 -0.0005 -2.8315
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Ag 12.37088 4.83277 2.05179 0.0005 0.0005 0.0005 -2.9389
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Ag 8.10686 1.23103 6.79051 -0.0009 -0.0009 -0.0009 -2.9022
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Ag 11.43697 4.43881 4.90756 0.0005 0.0005 0.0005 -2.8442
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Ag 10.08112 -0.74913 7.05882 0.0020 0.0020 0.0020 -2.8535
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Ag 12.87027 2.17600 4.49583 -0.0004 -0.0004 -0.0004 -2.8157
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Ag 7.73691 3.64753 2.40333 0.0013 0.0013 0.0013 -2.9280
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Ag 9.74771 5.60037 3.15636 0.0022 0.0022 0.0022 -2.8355
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Ag 9.29827 0.54747 -1.76337 -0.0001 -0.0001 -0.0001 -2.3877
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Ag 8.35641 5.14435 -1.53713 -0.0048 -0.0048 -0.0048 -2.3752
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Ag 13.11181 2.10616 1.74420 -0.0007 -0.0007 -0.0007 -2.8383
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Ag 10.74948 7.11987 5.62348 -0.0005 -0.0005 -0.0005 -2.5239
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Ag 6.20654 -0.63935 7.73961 0.0013 0.0013 0.0013 -2.5549
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Ag 10.60033 2.71626 2.88748 0.0009 0.0009 0.0009 -2.8690
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Ag 7.38685 4.09017 7.44731 -0.0000 -0.0000 -0.0000 -2.5346
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Ag 13.54344 6.22705 4.83749 -0.0017 -0.0017 -0.0017 -2.4996
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Ag 10.67531 -3.15263 1.99406 -0.0009 -0.0009 -0.0009 -2.4286
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Ag 15.04026 -1.04964 5.82640 0.0033 0.0033 0.0033 -2.2377
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Ag 11.05434 -4.65423 4.44209 -0.0019 -0.0019 -0.0019 -2.3703
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Ag 10.92718 6.95605 0.54978 -0.0016 -0.0016 -0.0016 -2.4585
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Ag 8.34638 -4.00908 5.27796 0.0018 0.0018 0.0018 -2.5559
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Ag 7.81698 -1.28557 5.54127 0.0004 0.0004 0.0004 -2.8669
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Ag 5.24896 -0.48856 5.24558 0.0023 0.0023 0.0023 -2.5567
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Ag 10.81051 1.57105 0.30675 -0.0017 -0.0017 -0.0017 -2.8845
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Ag 10.28237 3.03221 -2.05348 -0.0003 -0.0003 -0.0003 -2.5311
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Ag 8.64636 -1.60391 2.94572 -0.0025 -0.0025 -0.0025 -2.8597
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Ag 8.16413 -2.71452 7.90335 0.0002 0.0002 0.0002 -2.5554
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Ag 12.82498 -2.68364 3.14235 -0.0014 -0.0014 -0.0014 -2.3956
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Ag 12.70788 -0.58253 0.27829 0.0011 0.0011 0.0011 -2.4782
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Ag 10.66795 -2.04376 4.87432 0.0018 0.0018 0.0018 -2.7721
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Ag 9.78972 -1.12084 0.35091 0.0021 0.0021 0.0021 -2.6811
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Ag 7.08878 1.38180 4.25222 0.0006 0.0006 0.0006 -2.7901
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Ag 5.85350 1.93784 1.23587 -0.0015 -0.0015 -0.0015 -2.5982
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Ag 12.04622 0.83658 -1.97478 -0.0013 -0.0013 -0.0013 -2.3534
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Ag 4.69180 4.12390 2.37974 -0.0018 -0.0018 -0.0018 -2.3052
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Ag 14.19249 -0.10312 3.03453 -0.0021 -0.0021 -0.0021 -2.6231
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Ag 6.72233 1.98277 9.14684 0.0003 0.0003 0.0003 -2.3202
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Ag 9.92273 4.79469 7.24962 -0.0021 -0.0021 -0.0021 -2.6028
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Ag 14.90815 4.11335 3.76614 -0.0022 -0.0022 -0.0022 -2.6171
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Ag 12.30955 3.43413 8.61358 0.0001 0.0001 0.0001 -2.4397
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Ag 8.65008 0.00274 9.34141 -0.0021 -0.0021 -0.0021 -2.5427
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Ag 8.13534 2.66837 -0.29788 -0.0007 -0.0007 -0.0007 -2.7335
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Ag 15.49538 1.57266 5.04123 -0.0011 -0.0011 -0.0011 -2.4703
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Ag 15.80752 1.91379 2.14619 -0.0015 -0.0015 -0.0015 -2.3334
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Ag 6.38129 4.76093 0.39558 0.0007 0.0007 0.0007 -2.4043
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Ag 6.11124 3.93120 4.78609 -0.0016 -0.0016 -0.0016 -2.6781
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Ag 6.84036 6.25714 3.16158 -0.0011 -0.0011 -0.0011 -2.4756
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Ag 9.05990 8.09137 3.57462 0.0006 0.0006 0.0006 -2.2947
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Ag 5.53864 1.95049 6.63533 0.0004 0.0004 0.0004 -2.5551
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Ag 14.95734 4.21362 0.94438 -0.0010 -0.0010 -0.0010 -2.5245
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Ag 12.69744 -1.49152 7.88236 -0.0008 -0.0008 -0.0008 -2.5556
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Ag 13.69154 1.35672 7.34254 -0.0011 -0.0011 -0.0011 -2.5993
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Ag 14.52241 6.58494 2.37759 -0.0002 -0.0002 -0.0002 -2.3290
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Ag 7.25974 -0.04827 -0.03559 0.0015 0.0015 0.0015 -2.5124
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Ag 7.43737 -2.68220 0.83895 0.0006 0.0006 0.0006 -2.3583
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Ag 5.83927 -2.98684 6.35252 0.0022 0.0022 0.0022 -2.3450
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Ag 10.96569 5.58230 -1.93552 -0.0020 -0.0020 -0.0020 -2.2997
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Ag 4.54661 1.75590 3.73253 0.0005 0.0005 0.0005 -2.4279
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Ag 8.43447 -4.50207 2.66219 0.0013 0.0013 0.0013 -2.3278
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Ag 11.45136 0.77137 9.04646 -0.0048 -0.0048 -0.0048 -2.5712
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Ag 10.87245 -3.38487 7.35307 0.0020 0.0020 0.0020 -2.4956
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Ag 10.48164 -1.97880 9.57211 0.0019 0.0019 0.0019 -2.3133
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Ag 6.22543 -0.42028 2.55891 0.0003 0.0003 0.0003 -2.6495
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Ag 12.64118 3.65232 -0.59993 0.0006 0.0006 0.0006 -2.7432
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Ag 13.52628 6.38079 -0.01597 -0.0013 -0.0013 -0.0013 -2.3207
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Ag 11.69545 7.31402 2.96288 0.0016 0.0016 0.0016 -2.4633
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Ag 8.21385 6.49246 0.81121 -0.0015 -0.0015 -0.0015 -2.4747
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Ag 14.34493 1.49926 -0.61027 0.0004 0.0004 0.0004 -2.3231
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Ag 12.42695 5.72225 7.21467 0.0015 0.0015 0.0015 -2.3393
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Ag 14.31646 3.95475 6.52093 0.0016 0.0016 0.0016 -2.4854
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Ag 9.49617 2.74758 8.98810 0.0013 0.0013 0.0013 -2.5612
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Ag 13.03869 -3.34898 5.76287 0.0014 0.0014 0.0014 -2.4252
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Ag 8.07997 6.03873 5.41025 -0.0023 -0.0023 -0.0023 -2.5574
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Ag 6.30396 -3.03070 3.59741 0.0010 0.0010 0.0010 -2.5074
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Ag 12.53137 -0.29402 5.38742 0.0026 0.0026 0.0026 -2.7882
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