103 lines
10 KiB
Plaintext
103 lines
10 KiB
Plaintext
100
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Ag Ag pos(A), vel, pot-en(eV)
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Ag 5.39453 47.35675 10.05514 -0.0001 -0.0001 -0.0001 -2.9260
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Ag 7.60317 43.64670 12.43022 0.0002 0.0002 0.0002 -2.8528
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Ag 5.30041 41.76059 11.87887 0.0034 0.0034 0.0034 -2.9098
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Ag 5.46932 50.08624 9.20029 -0.0013 -0.0013 -0.0013 -2.9124
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Ag 1.42464 47.51283 10.70752 -0.0006 -0.0006 -0.0006 -2.8933
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Ag 5.39727 44.56640 10.99612 0.0013 0.0013 0.0013 -2.9189
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Ag 4.94865 46.26308 7.39155 -0.0007 -0.0007 -0.0007 -2.9072
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Ag 3.59311 49.21355 11.21128 0.0008 0.0008 0.0008 -2.9150
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Ag 2.95451 48.12698 8.47882 0.0013 0.0013 0.0013 -2.8525
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Ag 5.89892 50.98171 11.99076 -0.0014 -0.0014 -0.0014 -2.8985
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Ag 7.29672 48.26113 8.12354 0.0011 0.0011 0.0011 -2.8812
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Ag 2.95709 42.66533 10.32620 -0.0018 -0.0018 -0.0018 -2.9203
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Ag 0.70685 46.41934 7.75504 -0.0040 -0.0040 -0.0040 -2.6117
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Ag 5.51766 39.26178 13.07287 -0.0008 -0.0008 -0.0008 -2.3796
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Ag 2.30501 39.15376 8.38696 0.0054 0.0054 0.0054 -2.5384
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Ag 7.19721 45.35546 8.82501 0.0012 0.0012 0.0012 -2.8664
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Ag 1.07746 49.40425 7.09364 -0.0009 -0.0009 -0.0009 -2.4482
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Ag 4.27588 50.32860 14.17598 0.0007 0.0007 0.0007 -2.5244
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Ag 3.08050 45.47386 9.40012 -0.0006 -0.0006 -0.0006 -2.9251
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Ag -0.11336 49.45238 12.02305 0.0000 0.0000 0.0000 -2.3222
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Ag 6.83667 47.06492 5.44921 -0.0002 -0.0002 -0.0002 -2.6037
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Ag 10.20704 43.49758 12.56919 0.0011 0.0011 0.0011 -2.4007
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Ag 9.50868 49.97885 8.83496 -0.0001 -0.0001 -0.0001 -2.4937
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Ag 10.29939 46.34438 11.95657 0.0018 0.0018 0.0018 -2.4948
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Ag 2.64778 44.60088 6.79865 0.0012 0.0012 0.0012 -2.6998
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Ag 8.64906 48.28561 13.29657 0.0006 0.0006 0.0006 -2.6835
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Ag 5.80399 48.18739 12.69971 0.0003 0.0003 0.0003 -2.9087
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Ag 1.92542 48.40242 13.46439 0.0016 0.0016 0.0016 -2.6576
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Ag 7.04404 42.49190 9.62658 -0.0015 -0.0015 -0.0015 -2.9106
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Ag 4.73371 38.13027 10.29126 -0.0019 -0.0019 -0.0019 -2.3950
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Ag 6.02059 45.68895 13.72664 -0.0007 -0.0007 -0.0007 -2.8709
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Ag 6.96088 52.92754 13.72719 0.0011 0.0011 0.0011 -2.2614
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Ag 9.40150 44.43335 10.20217 0.0017 0.0017 0.0017 -2.6861
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Ag 7.74770 41.01723 13.40793 0.0022 0.0022 0.0022 -2.5869
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Ag 7.53433 46.20951 11.35108 -0.0014 -0.0014 -0.0014 -2.8868
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Ag 6.92791 44.94410 16.18972 0.0020 0.0020 0.0020 -2.5061
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Ag 3.55841 46.39216 12.07927 0.0014 0.0014 0.0014 -2.8695
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Ag 1.49558 42.12198 12.61905 -0.0000 -0.0000 -0.0000 -2.6326
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Ag 6.87258 39.68890 10.58155 0.0024 0.0024 0.0024 -2.5950
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Ag -0.83337 45.71940 9.97827 -0.0006 -0.0006 -0.0006 -2.4475
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Ag 9.48343 47.16645 9.44025 -0.0014 -0.0014 -0.0014 -2.7008
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Ag 1.96302 51.07819 12.50014 -0.0025 -0.0025 -0.0025 -2.4559
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Ag 1.48316 50.29994 9.79308 0.0013 0.0013 0.0013 -2.6556
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Ag 8.86749 46.07134 6.86029 -0.0015 -0.0015 -0.0015 -2.4397
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Ag 3.34812 51.16038 7.85335 -0.0028 -0.0028 -0.0028 -2.6161
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Ag 4.32617 52.92012 13.34799 0.0029 0.0029 0.0029 -2.3220
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Ag 2.65427 39.74221 10.95921 0.0000 0.0000 0.0000 -2.4676
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Ag 9.18188 48.90320 6.34486 -0.0021 -0.0021 -0.0021 -2.3387
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Ag 8.75330 43.25142 7.56790 -0.0010 -0.0010 -0.0010 -2.5588
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Ag -0.62451 43.16541 11.11559 -0.0015 -0.0015 -0.0015 -2.4062
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Ag 1.49999 44.83090 11.65391 0.0018 0.0018 0.0018 -2.8440
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Ag 0.68145 43.69426 8.73286 -0.0005 -0.0005 -0.0005 -2.7086
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Ag 2.71398 47.32335 5.93731 0.0001 0.0001 0.0001 -2.6494
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Ag -0.25579 46.70233 12.83388 0.0008 0.0008 0.0008 -2.4813
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Ag 6.37993 41.36540 6.84038 0.0004 0.0004 0.0004 -2.6355
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Ag 7.83889 51.85711 10.11697 -0.0001 -0.0001 -0.0001 -2.6336
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Ag 7.49015 51.11409 7.35932 0.0037 0.0037 0.0037 -2.6285
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Ag 6.51711 44.08728 5.97516 0.0012 0.0012 0.0012 -2.5938
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Ag 3.76414 43.82872 13.17925 -0.0002 -0.0002 -0.0002 -2.8936
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Ag 4.12147 44.77110 15.71237 -0.0032 -0.0032 -0.0032 -2.5929
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Ag 6.93289 50.29242 14.56466 0.0000 0.0000 0.0000 -2.4829
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Ag 6.49565 38.82392 8.07587 0.0015 0.0015 0.0015 -2.4242
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Ag 2.08264 43.06823 15.31281 -0.0020 -0.0020 -0.0020 -2.4726
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Ag 8.71145 45.57345 14.07505 -0.0010 -0.0010 -0.0010 -2.6531
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Ag 5.66856 52.84117 8.44933 -0.0007 -0.0007 -0.0007 -2.5264
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Ag 8.62904 50.99719 12.54646 -0.0000 -0.0000 -0.0000 -2.4987
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Ag 5.96681 53.60092 11.03719 -0.0013 -0.0013 -0.0013 -2.4573
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Ag 1.92005 45.71228 14.27969 -0.0015 -0.0015 -0.0015 -2.6835
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Ag 4.89520 43.53140 8.22747 -0.0015 -0.0015 -0.0015 -2.9275
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Ag 4.22344 42.58783 5.56932 -0.0011 -0.0011 -0.0011 -2.4932
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Ag 4.46402 45.43762 4.83260 0.0025 0.0025 0.0025 -2.4816
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Ag 4.78014 40.77093 9.18751 0.0008 0.0008 0.0008 -2.9331
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Ag 9.07258 41.31967 10.98923 0.0000 0.0000 0.0000 -2.5378
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Ag 2.83394 49.93315 5.03846 0.0034 0.0034 0.0034 -2.3536
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Ag 4.88595 48.87794 6.54989 0.0019 0.0019 0.0019 -2.8370
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Ag 3.72846 52.09368 10.56197 0.0007 0.0007 0.0007 -2.6486
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Ag 10.39744 49.10086 11.29772 -0.0010 -0.0010 -0.0010 -2.3754
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Ag -0.72870 48.34425 9.00151 -0.0042 -0.0042 -0.0042 -2.3074
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Ag 4.22529 47.50141 14.93464 0.0024 0.0024 0.0024 -2.5843
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Ag 7.62113 48.99025 10.71509 0.0013 0.0013 0.0013 -2.9117
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Ag 8.49774 40.42159 8.28195 -0.0018 -0.0018 -0.0018 -2.4070
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Ag 4.51344 47.99858 3.88744 -0.0006 -0.0006 -0.0006 -2.3549
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Ag 8.75381 42.98314 14.96573 -0.0000 -0.0000 -0.0000 -2.4930
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Ag 7.03097 47.62616 15.42466 -0.0011 -0.0011 -0.0011 -2.4653
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Ag 4.99762 51.45977 5.66152 -0.0021 -0.0021 -0.0021 -2.3392
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Ag 0.58254 40.94491 9.71264 -0.0021 -0.0021 -0.0021 -2.5199
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Ag 6.86297 49.59985 4.82813 -0.0028 -0.0028 -0.0028 -2.3619
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Ag 5.88761 42.80551 14.49099 -0.0003 -0.0003 -0.0003 -2.8768
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Ag 2.49372 41.74624 7.59778 -0.0013 -0.0013 -0.0013 -2.7774
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Ag 1.54614 40.06628 5.83113 0.0006 0.0006 0.0006 -2.1421
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Ag -0.21352 43.95014 13.73226 -0.0010 -0.0010 -0.0010 -2.3597
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Ag 3.57819 40.97551 13.99016 -0.0003 -0.0003 -0.0003 -2.5835
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Ag 4.24183 37.38185 7.75247 0.0007 0.0007 0.0007 -2.1489
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Ag 7.11563 42.39852 17.10592 0.0010 0.0010 0.0010 -2.2465
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Ag -0.17268 41.59635 7.16294 0.0011 0.0011 0.0011 -2.1466
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Ag 4.15415 39.72404 6.39866 -0.0012 -0.0012 -0.0012 -2.5330
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Ag 4.35553 42.17052 16.66864 -0.0027 -0.0027 -0.0027 -2.3753
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Ag 8.20027 54.18994 9.01283 0.0009 0.0009 0.0009 -1.8445
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Ag 10.81329 42.42147 9.22773 0.0001 0.0001 0.0001 -2.0937
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Ag 6.13881 40.39789 15.66168 -0.0008 -0.0008 -0.0008 -2.3439
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