91 lines
8.8 KiB
Plaintext
91 lines
8.8 KiB
Plaintext
88
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -2.11125 3.65903 -4.02706 -0.0018 -0.0018 -0.0018 -2.5317
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Ag 3.22052 0.12217 -1.62678 0.0048 0.0048 0.0048 -2.8666
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Ag 4.58655 2.42167 -0.34976 0.0021 0.0021 0.0021 -2.6281
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Ag -3.69536 -0.82973 -4.57616 -0.0001 -0.0001 -0.0001 -2.4585
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Ag 4.01729 0.84837 -4.15365 0.0019 0.0019 0.0019 -2.4895
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Ag 0.75626 -0.19425 1.45171 -0.0013 -0.0013 -0.0013 -2.9053
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Ag -6.32098 0.42913 0.72746 -0.0010 -0.0010 -0.0010 -2.3126
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Ag -5.49920 2.48605 -0.99557 -0.0021 -0.0021 -0.0021 -2.5539
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Ag 2.18090 1.20580 -6.20523 -0.0008 -0.0008 -0.0008 -2.2410
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Ag 1.75409 2.00543 -0.21627 0.0022 0.0022 0.0022 -2.8527
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Ag -2.81636 2.91205 -1.41189 0.0000 0.0000 0.0000 -2.8052
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Ag -4.13967 -3.45201 -3.83654 -0.0044 -0.0044 -0.0044 -2.4117
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Ag 3.63533 0.27139 1.24539 0.0016 0.0016 0.0016 -2.9311
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Ag 4.01215 -0.90470 5.30965 -0.0024 -0.0024 -0.0024 -2.5148
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Ag 0.59672 -3.42047 -5.02504 0.0013 0.0013 0.0013 -2.5705
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Ag -0.98625 4.36828 3.87240 0.0005 0.0005 0.0005 -2.5460
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Ag 1.10439 0.32320 -3.95839 0.0000 0.0000 0.0000 -2.8383
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Ag -0.02113 -0.88843 -6.14171 -0.0025 -0.0025 -0.0025 -2.4611
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Ag -0.66795 -1.89382 6.50268 0.0003 0.0003 0.0003 -2.2377
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Ag 2.40318 -2.01711 0.12217 -0.0002 -0.0002 -0.0002 -2.9419
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Ag -1.42978 1.12506 -4.68170 -0.0010 -0.0010 -0.0010 -2.6651
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Ag 1.53913 -4.83014 0.29721 -0.0017 -0.0017 -0.0017 -2.6794
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Ag -4.47339 0.19093 3.00993 0.0016 0.0016 0.0016 -2.5617
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Ag 0.43304 6.56386 -0.43224 -0.0004 -0.0004 -0.0004 -2.2571
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Ag -2.39763 0.29762 -2.18230 0.0013 0.0013 0.0013 -2.8723
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Ag -3.67997 -5.07768 -1.62253 0.0008 0.0008 0.0008 -2.2861
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Ag 2.71693 -1.41071 -5.35080 0.0026 0.0026 0.0026 -2.5757
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Ag -2.15600 -2.89888 -5.70532 -0.0008 -0.0008 -0.0008 -2.3340
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Ag 4.60748 3.69381 4.47019 0.0047 0.0047 0.0047 -2.2203
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Ag -2.25530 -3.70284 1.07007 -0.0019 -0.0019 -0.0019 -2.6083
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Ag -5.58591 -3.09614 -1.49829 0.0011 0.0011 0.0011 -2.2513
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Ag 3.52191 1.76135 6.05226 0.0013 0.0013 0.0013 -2.3569
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Ag -0.18504 -2.95204 -0.96677 0.0001 0.0001 0.0001 -2.9226
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Ag 5.12503 -1.71372 2.51216 -0.0011 -0.0011 -0.0011 -2.5173
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Ag 4.17355 -3.66203 4.18560 0.0028 0.0028 0.0028 -2.3248
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Ag -1.55653 5.90710 1.47196 -0.0015 -0.0015 -0.0015 -2.5169
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Ag -4.15018 1.83575 -3.52306 -0.0021 -0.0021 -0.0021 -2.5112
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Ag -1.44029 -4.21733 -3.18500 0.0007 0.0007 0.0007 -2.6716
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Ag -0.06241 4.09204 0.03325 -0.0011 -0.0011 -0.0011 -2.7865
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Ag 4.64909 -1.74679 -3.16770 0.0009 0.0009 0.0009 -2.5601
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Ag 1.75008 -4.71365 3.13513 -0.0012 -0.0012 -0.0012 -2.5644
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Ag -3.61676 0.93953 0.43368 0.0014 0.0014 0.0014 -2.8791
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Ag 5.10954 1.01538 3.67101 -0.0013 -0.0013 -0.0013 -2.6279
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Ag 3.96327 -3.90747 1.36722 -0.0006 -0.0006 -0.0006 -2.5523
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Ag -2.16235 5.44670 -1.66298 -0.0016 -0.0016 -0.0016 -2.5044
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Ag -0.74595 -3.82453 4.25938 -0.0024 -0.0024 -0.0024 -2.4877
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Ag -1.72344 -1.14580 0.57365 -0.0026 -0.0026 -0.0026 -2.8533
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Ag -0.29683 1.74861 4.98915 0.0023 0.0023 0.0023 -2.6716
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Ag 1.90573 -2.13234 -2.73396 -0.0010 -0.0010 -0.0010 -2.8906
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Ag -4.12300 4.88631 0.22363 0.0002 0.0002 0.0002 -2.5119
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Ag 3.03125 2.85683 1.94041 0.0037 0.0037 0.0037 -2.7658
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Ag 0.78829 3.21054 -4.76593 0.0014 0.0014 0.0014 -2.4272
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Ag 2.58501 4.61307 -0.23745 -0.0028 -0.0028 -0.0028 -2.5098
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Ag -0.92395 -5.55023 -0.72214 0.0024 0.0024 0.0024 -2.4752
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Ag -5.11007 -0.38468 -1.78809 -0.0010 -0.0010 -0.0010 -2.6374
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Ag -0.23309 2.29991 -2.36969 -0.0011 -0.0011 -0.0011 -2.8865
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Ag 0.43624 -0.28183 -1.29133 -0.0005 -0.0005 -0.0005 -2.8691
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Ag 0.35867 2.50187 2.35256 -0.0009 -0.0009 -0.0009 -2.8973
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Ag -1.73338 0.71005 2.74166 -0.0036 -0.0036 -0.0036 -2.8822
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Ag 3.27764 -3.96667 -4.25240 -0.0029 -0.0029 -0.0029 -2.3468
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Ag -2.63318 -2.03044 3.14235 0.0017 0.0017 0.0017 -2.6294
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Ag -0.95443 -1.55326 -3.56867 -0.0004 -0.0004 -0.0004 -2.8991
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Ag -0.65136 -5.67055 1.95674 0.0016 0.0016 0.0016 -2.3302
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Ag 1.24166 -4.82769 -2.54849 -0.0004 -0.0004 -0.0004 -2.5808
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Ag 5.83437 0.41823 -1.93750 -0.0033 -0.0033 -0.0033 -2.3069
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Ag 3.72398 -3.91503 -1.53313 0.0005 0.0005 0.0005 -2.5420
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Ag -4.50497 -1.80381 0.77035 -0.0051 -0.0051 -0.0051 -2.6536
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Ag 2.54151 -1.90021 2.93893 0.0008 0.0008 0.0008 -2.8386
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Ag 0.22988 -2.80870 1.94446 0.0043 0.0043 0.0043 -2.8581
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Ag 2.23930 0.80234 3.71399 -0.0003 -0.0003 -0.0003 -2.9409
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Ag -5.10376 2.80491 1.99679 -0.0025 -0.0025 -0.0025 -2.5523
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Ag 5.28929 -1.50102 -0.11442 0.0023 0.0023 0.0023 -2.5704
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Ag 1.70278 -2.83494 5.39471 -0.0029 -0.0029 -0.0029 -2.5758
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Ag -0.98171 1.46073 0.12133 0.0035 0.0035 0.0035 -2.7068
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Ag 5.81478 3.10653 2.02187 -0.0012 -0.0012 -0.0012 -2.2176
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Ag -2.94882 -2.33760 -1.54585 0.0002 0.0002 0.0002 -2.8667
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Ag 6.58968 0.83944 1.37582 0.0023 0.0023 0.0023 -2.2518
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Ag 0.47466 4.92424 -2.63470 0.0022 0.0022 0.0022 -2.5115
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Ag -3.73832 4.97334 3.05364 -0.0012 -0.0012 -0.0012 -2.3331
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Ag 2.48960 2.69186 -2.77869 0.0005 0.0005 0.0005 -2.6330
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Ag 1.20870 5.21462 2.22495 0.0024 0.0024 0.0024 -2.5446
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Ag -2.46101 3.16274 1.50743 0.0022 0.0022 0.0022 -2.8230
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Ag -3.20224 2.47772 4.19739 0.0030 0.0030 0.0030 -2.5537
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Ag 1.53606 -0.06837 6.36275 -0.0017 -0.0017 -0.0017 -2.4803
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Ag 1.82318 3.60969 4.60914 -0.0020 -0.0020 -0.0020 -2.5247
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Ag -4.69391 4.30042 -2.97667 -0.0051 -0.0051 -0.0051 -2.2473
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Ag 0.06675 -0.95557 4.10184 0.0007 0.0007 0.0007 -2.8873
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Ag -2.41455 -0.05475 5.30354 0.0017 0.0017 0.0017 -2.4432
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