97 lines
9.4 KiB
Plaintext
97 lines
9.4 KiB
Plaintext
94
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -37.70052 -29.02090 17.74674 -0.0026 -0.0026 -0.0026 -2.8929
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Ag -39.53030 -28.65854 15.80186 0.0025 0.0025 0.0025 -2.9082
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Ag -41.23299 -27.24248 17.60558 -0.0034 -0.0034 -0.0034 -2.9350
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Ag -36.54728 -28.16907 20.06797 -0.0000 -0.0000 -0.0000 -2.9031
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Ag -35.66363 -30.60371 19.28940 0.0000 0.0000 0.0000 -2.8234
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Ag -40.32276 -31.60751 15.83839 -0.0039 -0.0039 -0.0039 -2.9368
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Ag -38.52089 -26.34282 17.13670 -0.0020 -0.0020 -0.0020 -2.9516
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Ag -35.91223 -32.50636 16.62305 -0.0030 -0.0030 -0.0030 -2.8764
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Ag -39.32521 -27.63913 19.58601 0.0008 0.0008 0.0008 -2.9157
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Ag -39.79763 -30.47576 13.24280 0.0007 0.0007 0.0007 -2.6366
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Ag -36.92602 -27.77938 15.24847 0.0013 0.0013 0.0013 -2.9291
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Ag -38.35116 -31.82866 17.92284 -0.0003 -0.0003 -0.0003 -2.8957
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Ag -38.40558 -30.19846 20.34291 0.0001 0.0001 0.0001 -2.8899
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Ag -41.51373 -28.25213 13.91498 -0.0003 -0.0003 -0.0003 -2.5411
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Ag -42.08644 -28.57935 19.98218 0.0028 0.0028 0.0028 -2.6351
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Ag -34.50136 -26.10674 20.01528 0.0004 0.0004 0.0004 -2.7172
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Ag -30.36858 -28.35948 20.03728 -0.0024 -0.0024 -0.0024 -2.2464
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Ag -42.77527 -34.08493 14.18424 0.0010 0.0010 0.0010 -2.2394
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Ag -44.69425 -25.33588 17.36230 0.0007 0.0007 0.0007 -2.1996
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Ag -37.12640 -29.54622 12.84412 0.0014 0.0014 0.0014 -2.5434
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Ag -37.04375 -22.18289 21.26359 -0.0015 -0.0015 -0.0015 -2.2509
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Ag -36.32689 -26.66733 12.76614 -0.0016 -0.0016 -0.0016 -2.3251
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Ag -36.02619 -24.55883 22.14237 0.0015 0.0015 0.0015 -2.4257
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Ag -38.60273 -34.39899 18.40142 0.0010 0.0010 0.0010 -2.4616
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Ag -39.84375 -28.67983 22.34228 -0.0023 -0.0023 -0.0023 -2.5127
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Ag -42.27682 -29.57510 16.26680 0.0035 0.0035 0.0035 -2.8631
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Ag -38.94368 -27.50707 13.30003 -0.0021 -0.0021 -0.0021 -2.5611
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Ag -44.83265 -30.39588 16.77083 -0.0017 -0.0017 -0.0017 -2.2699
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Ag -41.65783 -23.61576 20.85939 0.0006 0.0006 0.0006 -2.4526
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Ag -40.56996 -26.10490 15.07033 -0.0008 -0.0008 -0.0008 -2.6366
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Ag -34.98241 -25.62364 15.12138 0.0023 0.0023 0.0023 -2.5515
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Ag -40.34770 -33.30192 13.44521 0.0013 0.0013 0.0013 -2.6409
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Ag -37.70905 -25.11668 14.70982 0.0004 0.0004 0.0004 -2.5606
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Ag -40.25507 -25.02739 18.91236 -0.0003 -0.0003 -0.0003 -2.8759
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Ag -32.73223 -30.24259 15.21937 -0.0045 -0.0045 -0.0045 -2.5687
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Ag -41.06350 -32.82807 18.36643 0.0011 0.0011 0.0011 -2.6567
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Ag -38.23859 -33.48401 15.63332 0.0033 0.0033 0.0033 -2.8623
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Ag -39.04109 -32.90680 20.52302 -0.0008 -0.0008 -0.0008 -2.4653
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Ag -40.99439 -31.00008 20.83270 -0.0005 -0.0005 -0.0005 -2.5410
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Ag -31.64461 -34.56969 16.76566 -0.0014 -0.0014 -0.0014 -2.1565
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Ag -33.36481 -31.47503 17.74838 0.0042 0.0042 0.0042 -2.9287
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Ag -37.72255 -30.73372 15.27334 0.0012 0.0012 0.0012 -2.9169
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Ag -35.12218 -31.18419 14.18750 0.0020 0.0020 0.0020 -2.6619
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Ag -32.83541 -27.98783 21.20276 -0.0052 -0.0052 -0.0052 -2.4314
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Ag -34.72259 -29.94854 21.58583 -0.0033 -0.0033 -0.0033 -2.6042
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Ag -37.77238 -32.46756 12.88391 0.0002 0.0002 0.0002 -2.4978
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Ag -34.12280 -35.89131 15.53230 0.0016 0.0016 0.0016 -2.2994
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Ag -33.91972 -24.91961 17.53018 0.0011 0.0011 0.0011 -2.4395
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Ag -35.63653 -26.84640 17.71547 0.0013 0.0013 0.0013 -2.8470
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Ag -35.33000 -29.75508 16.46503 -0.0003 -0.0003 -0.0003 -2.8932
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Ag -36.41206 -33.46171 19.31911 -0.0009 -0.0009 -0.0009 -2.5718
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Ag -36.80182 -32.14874 21.53630 0.0016 0.0016 0.0016 -2.4775
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Ag -37.93719 -26.67337 22.08571 -0.0003 -0.0003 -0.0003 -2.6380
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Ag -34.54365 -28.39202 13.88567 0.0006 0.0006 0.0006 -2.4961
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Ag -41.12527 -26.43485 21.26577 0.0004 0.0004 0.0004 -2.5251
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Ag -37.22917 -29.42814 22.67835 -0.0005 -0.0005 -0.0005 -2.5574
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Ag -33.51667 -27.71544 16.14020 0.0002 0.0002 0.0002 -2.6203
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Ag -42.37362 -31.25190 13.96210 0.0004 0.0004 0.0004 -2.5770
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Ag -32.24045 -30.44784 20.22484 -0.0006 -0.0006 -0.0006 -2.6691
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Ag -33.88209 -28.61452 18.99792 -0.0024 -0.0024 -0.0024 -2.7239
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Ag -40.87322 -34.41302 16.05459 0.0003 0.0003 0.0003 -2.6440
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Ag -43.41453 -23.07598 18.91339 0.0010 0.0010 0.0010 -2.2027
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Ag -30.92963 -31.87697 16.55702 -0.0009 -0.0009 -0.0009 -2.4624
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Ag -35.19210 -27.19705 22.51712 0.0013 0.0013 0.0013 -2.4665
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Ag -37.05393 -25.33498 19.69268 0.0020 0.0020 0.0020 -2.8521
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Ag -34.05533 -32.63082 20.29730 0.0002 0.0002 0.0002 -2.5411
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Ag -41.02357 -22.47305 18.26749 -0.0003 -0.0003 -0.0003 -2.4096
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Ag -32.11344 -26.73916 18.60403 -0.0001 -0.0001 -0.0001 -2.4622
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Ag -38.25832 -23.04914 18.83240 -0.0022 -0.0022 -0.0022 -2.6485
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Ag -40.35442 -29.96789 18.29431 0.0023 0.0023 0.0023 -2.9218
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Ag -43.05542 -30.83010 18.76489 -0.0044 -0.0044 -0.0044 -2.5511
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Ag -39.25567 -31.49003 22.71939 -0.0001 -0.0001 -0.0001 -2.3081
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Ag -38.06838 -34.99094 13.47781 0.0009 0.0009 0.0009 -2.4252
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Ag -44.16514 -29.16940 14.44473 -0.0010 -0.0010 -0.0010 -2.2731
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Ag -38.71913 -36.17553 15.85930 -0.0011 -0.0011 -0.0011 -2.4587
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Ag -36.29338 -35.13853 17.04139 0.0005 0.0005 0.0005 -2.6508
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Ag -39.32407 -23.67177 16.50811 -0.0005 -0.0005 -0.0005 -2.5359
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Ag -35.71228 -33.98052 14.41631 -0.0025 -0.0025 -0.0025 -2.6538
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Ag -40.74200 -35.94233 13.82590 0.0027 0.0027 0.0027 -2.2350
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Ag -33.22897 -33.02339 15.44223 0.0021 0.0021 0.0021 -2.6259
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Ag -43.25874 -26.87290 15.56805 0.0012 0.0012 0.0012 -2.5753
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Ag -29.74582 -30.77553 19.00582 -0.0018 -0.0018 -0.0018 -2.2306
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Ag -36.51864 -24.23013 17.01401 0.0004 0.0004 0.0004 -2.6643
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Ag -33.92262 -34.21837 17.98805 -0.0001 -0.0001 -0.0001 -2.6099
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Ag -36.51339 -36.89500 14.44258 -0.0021 -0.0021 -0.0021 -2.1704
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Ag -35.22807 -23.38331 19.57829 0.0006 0.0006 0.0006 -2.4287
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Ag -42.01507 -24.49177 16.91884 0.0015 0.0015 0.0015 -2.6440
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Ag -31.37412 -32.81802 19.40742 0.0005 0.0005 0.0005 -2.3658
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Ag -39.76353 -21.70865 20.74832 0.0024 0.0024 0.0024 -2.2533
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Ag -42.97661 -25.92921 19.33796 -0.0012 -0.0012 -0.0012 -2.6558
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Ag -31.61273 -29.32119 17.58031 -0.0024 -0.0024 -0.0024 -2.6839
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Ag -39.02838 -24.28374 21.32356 0.0004 0.0004 0.0004 -2.6535
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Ag -42.96188 -32.41785 16.39601 -0.0009 -0.0009 -0.0009 -2.5955
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Ag -44.07344 -28.07307 17.91466 0.0025 0.0025 0.0025 -2.5725
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