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 -5.92298 -2.85755 -1.23604 0.0028 0.0028 0.0028 -2.3993
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Ag -2.06317 -2.06188 4.91527 0.0018 0.0018 0.0018 -2.5351
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Ag -2.12044 4.89807 5.51707 -0.0017 -0.0017 -0.0017 -2.2601
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Ag 0.82583 0.79200 -0.09638 -0.0024 -0.0024 -0.0024 -2.8907
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Ag -3.41770 -4.09746 3.71573 -0.0011 -0.0011 -0.0011 -2.3571
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Ag 4.79003 0.20698 -1.04700 -0.0026 -0.0026 -0.0026 -2.8742
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Ag -3.67801 3.53554 -1.73481 -0.0009 -0.0009 -0.0009 -2.7285
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Ag 2.37466 -2.30517 -5.58249 0.0002 0.0002 0.0002 -2.3919
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Ag 4.96879 -2.80633 1.72509 -0.0002 -0.0002 -0.0002 -2.5696
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Ag 2.40989 -3.16464 -2.97591 -0.0029 -0.0029 -0.0029 -2.7545
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Ag 4.31167 -5.10269 -2.18453 0.0009 0.0009 0.0009 -2.5648
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Ag 1.60392 5.92805 1.61625 -0.0012 -0.0012 -0.0012 -2.3752
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Ag 1.19240 6.16563 -1.10543 -0.0014 -0.0014 -0.0014 -2.3375
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Ag -5.86621 1.12243 4.48110 0.0020 0.0020 0.0020 -2.3388
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Ag 0.30449 1.18491 -2.74945 0.0015 0.0015 0.0015 -2.8465
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Ag -1.23533 0.12983 3.35546 -0.0007 -0.0007 -0.0007 -2.9158
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Ag -2.49650 -1.85273 -3.25434 0.0013 0.0013 0.0013 -2.8285
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Ag -4.76633 -3.16040 -3.68623 -0.0016 -0.0016 -0.0016 -2.3770
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Ag 0.30766 -1.39143 -4.04137 0.0000 0.0000 0.0000 -2.8589
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Ag -1.67933 -2.19387 -5.81349 0.0025 0.0025 0.0025 -2.4025
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Ag 5.47706 3.11391 -0.84957 -0.0009 -0.0009 -0.0009 -2.5339
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Ag 3.47502 1.84933 0.90197 0.0030 0.0030 0.0030 -2.9188
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Ag 6.31092 -3.15609 -2.74079 0.0026 0.0026 0.0026 -2.4321
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Ag -4.94812 3.41302 3.08548 -0.0021 -0.0021 -0.0021 -2.5844
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Ag -3.94249 0.72614 2.48247 -0.0040 -0.0040 -0.0040 -2.9036
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Ag 2.13479 -0.81107 -1.98074 -0.0015 -0.0015 -0.0015 -2.8364
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Ag 6.15638 -4.46706 -0.27306 0.0004 0.0004 0.0004 -2.3076
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Ag 0.45553 2.22063 -5.28713 -0.0017 -0.0017 -0.0017 -2.3826
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Ag -2.25267 2.79786 3.88689 -0.0001 -0.0001 -0.0001 -2.8552
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Ag -0.51224 0.08890 6.18760 -0.0010 -0.0010 -0.0010 -2.4421
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Ag 3.94594 4.59935 0.77594 -0.0018 -0.0018 -0.0018 -2.4721
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Ag -1.72519 0.45318 -4.92698 -0.0011 -0.0011 -0.0011 -2.6419
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Ag 1.62976 -5.58440 -1.48304 -0.0007 -0.0007 -0.0007 -2.6552
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Ag 1.59267 3.76735 0.08735 0.0004 0.0004 0.0004 -2.8105
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Ag 4.37762 -2.46577 -0.90926 -0.0009 -0.0009 -0.0009 -2.8936
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Ag 7.24922 1.18966 -0.08173 0.0022 0.0022 0.0022 -2.3823
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Ag -4.09585 -0.81346 -5.22998 0.0024 0.0024 0.0024 -2.3833
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Ag -4.18674 -3.77913 1.04324 0.0006 0.0006 0.0006 -2.5818
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Ag -5.54157 -1.28095 1.21172 0.0035 0.0035 0.0035 -2.6715
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Ag -4.29551 1.74415 -4.04142 0.0008 0.0008 0.0008 -2.4704
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Ag 5.45772 0.03867 1.74048 0.0016 0.0016 0.0016 -2.6915
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Ag -7.22373 -0.28391 -0.87121 -0.0027 -0.0027 -0.0027 -2.2750
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Ag -2.78837 5.32502 2.91245 -0.0003 -0.0003 -0.0003 -2.4718
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Ag 5.15443 1.67285 -3.35604 0.0008 0.0008 0.0008 -2.4682
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Ag -0.91274 4.99224 0.76013 0.0013 0.0013 0.0013 -2.7562
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Ag -1.38157 -3.46890 0.20450 -0.0028 -0.0028 -0.0028 -2.8317
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Ag 2.88400 3.07266 -4.54071 0.0001 0.0001 0.0001 -2.3513
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Ag -2.72682 -1.81693 2.14018 0.0016 0.0016 0.0016 -2.8954
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Ag -0.35732 -6.26009 -3.54770 0.0030 0.0030 0.0030 -2.3493
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Ag 2.80370 3.08609 5.53709 -0.0009 -0.0009 -0.0009 -2.1310
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Ag -6.41033 1.46882 1.76937 0.0009 0.0009 0.0009 -2.4691
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Ag -4.90148 -1.71592 3.88268 0.0030 0.0030 0.0030 -2.4720
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Ag -3.29638 -1.42434 -0.52448 0.0005 0.0005 0.0005 -2.8908
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Ag 6.99001 -0.27203 -2.50494 -0.0025 -0.0025 -0.0025 -2.3514
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Ag 0.18617 -1.37826 1.54585 0.0001 0.0001 0.0001 -2.9309
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Ag -6.16363 2.19392 -2.08025 -0.0000 -0.0000 -0.0000 -2.3517
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Ag -0.56478 -3.58932 3.10711 -0.0009 -0.0009 -0.0009 -2.6767
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Ag -1.07031 2.77739 -1.00427 -0.0007 -0.0007 -0.0007 -2.9009
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Ag -1.81983 2.37383 6.55512 0.0025 0.0025 0.0025 -2.3512
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Ag 7.00449 -1.46925 0.03425 0.0009 0.0009 0.0009 -2.4693
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Ag 2.74179 1.92849 -2.00469 0.0000 0.0000 0.0000 -2.8576
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Ag -5.42442 -0.62846 -2.87839 0.0013 0.0013 0.0013 -2.6321
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Ag 3.44331 -4.88914 0.49698 -0.0017 -0.0017 -0.0017 -2.5830
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Ag 3.64108 -1.05673 3.67157 0.0017 0.0017 0.0017 -2.5667
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Ag 2.54480 0.47442 -4.40197 -0.0036 -0.0036 -0.0036 -2.6325
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Ag -1.18507 -6.02223 -0.97837 0.0002 0.0002 0.0002 -2.4879
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Ag 0.42176 2.42035 4.85625 0.0028 0.0028 0.0028 -2.7121
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Ag 1.52394 -3.04321 -0.30380 -0.0021 -0.0021 -0.0021 -2.9299
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Ag -1.84999 2.96711 -3.87209 -0.0010 -0.0010 -0.0010 -2.6157
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Ag -3.47723 0.17863 5.11962 -0.0031 -0.0031 -0.0031 -2.5997
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Ag 2.30518 3.48189 2.86559 0.0009 0.0009 0.0009 -2.7752
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Ag -4.38540 2.91546 5.63706 -0.0022 -0.0022 -0.0022 -2.3492
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Ag 0.24222 -4.13071 -5.21668 0.0042 0.0042 0.0042 -2.5320
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Ag -1.53574 5.35000 -1.94331 -0.0009 -0.0009 -0.0009 -2.4536
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Ag 3.25818 4.58651 -2.12950 -0.0026 -0.0026 -0.0026 -2.4852
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Ag 2.95043 -0.95041 0.94553 -0.0044 -0.0044 -0.0044 -2.9102
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Ag -0.26855 -3.70528 -2.40841 0.0013 0.0013 0.0013 -2.9338
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Ag 5.93070 2.84419 1.80643 0.0007 0.0007 0.0007 -2.3826
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Ag 2.17520 0.37195 5.49058 0.0007 0.0007 0.0007 -2.4124
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Ag -5.67710 3.56876 0.20126 -0.0008 -0.0008 -0.0008 -2.4602
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Ag -2.27392 -4.39135 -4.16090 0.0015 0.0015 0.0015 -2.5062
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Ag 4.45645 1.83649 3.85797 -0.0001 -0.0001 -0.0001 -2.4627
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Ag 0.64695 -5.28917 1.11997 -0.0009 -0.0009 -0.0009 -2.5861
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Ag 1.62281 0.68341 2.83881 -0.0019 -0.0019 -0.0019 -2.9165
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Ag 2.19522 -3.25850 2.47765 0.0004 0.0004 0.0004 -2.6814
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Ag 0.87065 -1.55675 4.41344 -0.0008 -0.0008 -0.0008 -2.6120
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Ag -0.57756 -1.18561 -1.33865 -0.0029 -0.0029 -0.0029 -2.9238
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Ag -1.75460 0.57302 0.67743 -0.0014 -0.0014 -0.0014 -2.8973
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Ag -0.23451 2.59868 1.96789 -0.0018 -0.0018 -0.0018 -2.9205
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Ag -3.09641 2.97255 0.95762 0.0008 0.0008 0.0008 -2.9045
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Ag -2.04479 -5.50266 1.81440 0.0003 0.0003 0.0003 -2.3868
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Ag -0.05804 4.89167 3.64945 0.0020 0.0020 0.0020 -2.5825
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Ag -2.53182 0.75414 -2.20895 -0.0013 -0.0013 -0.0013 -2.9110
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Ag 4.42886 -3.91859 -4.70741 -0.0014 -0.0014 -0.0014 -2.3691
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Ag -3.52222 5.63591 0.10096 -0.0015 -0.0015 -0.0015 -2.3524
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Ag -3.14516 -4.06248 -1.54716 -0.0017 -0.0017 -0.0017 -2.6420
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Ag 2.44610 -5.52075 -4.02496 0.0002 0.0002 0.0002 -2.3587
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Ag 4.42530 -1.33853 -3.65018 0.0001 0.0001 0.0001 -2.7214
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Ag 0.67296 3.87593 -2.96139 -0.0015 -0.0015 -0.0015 -2.7321
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Ag -4.62262 0.93348 -0.37679 -0.0017 -0.0017 -0.0017 -2.8610
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