96 lines
9.3 KiB
Plaintext
96 lines
9.3 KiB
Plaintext
93
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Ag Ag pos(A), vel, pot-en(eV)
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Ag 0.24796 5.29813 3.52406 -0.0043 -0.0043 -0.0043 -2.2827
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Ag -3.12724 0.02737 1.05480 0.0010 0.0010 0.0010 -2.9184
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Ag 4.28341 -1.15267 4.11612 0.0000 0.0000 0.0000 -2.6645
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Ag 1.15225 -2.09573 -1.70320 0.0021 0.0021 0.0021 -2.8309
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Ag 2.23799 1.81536 0.95860 -0.0000 -0.0000 -0.0000 -2.9124
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Ag -0.61979 1.55460 0.63622 0.0003 0.0003 0.0003 -2.8959
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Ag 0.65579 -2.46988 3.13491 0.0023 0.0023 0.0023 -2.8825
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Ag -4.83200 3.47178 1.86517 -0.0019 -0.0019 -0.0019 -2.5835
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Ag -1.27429 -0.77786 -0.89270 -0.0005 -0.0005 -0.0005 -2.8953
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Ag -2.47962 -4.73008 -3.60191 -0.0008 -0.0008 -0.0008 -2.4757
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Ag -2.57955 0.78224 -4.48148 -0.0023 -0.0023 -0.0023 -2.6680
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Ag -1.64229 -3.81939 3.76545 -0.0009 -0.0009 -0.0009 -2.5439
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Ag -1.37995 -1.50697 -5.94581 0.0002 0.0002 0.0002 -2.3573
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Ag 1.75538 -0.98667 -5.50447 -0.0007 -0.0007 -0.0007 -2.4026
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Ag -1.21576 3.38131 -4.51166 -0.0005 -0.0005 -0.0005 -2.5196
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Ag 5.68634 -1.78248 0.40199 -0.0022 -0.0022 -0.0022 -2.5520
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Ag 0.96874 0.60037 -1.48056 -0.0010 -0.0010 -0.0010 -2.7365
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Ag -3.17149 2.60037 -0.21694 -0.0008 -0.0008 -0.0008 -2.8925
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Ag 0.71955 -5.30253 2.86285 -0.0014 -0.0014 -0.0014 -2.5642
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Ag 5.17700 1.42770 -3.60534 0.0019 0.0019 0.0019 -2.4341
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Ag 2.98827 -2.77656 -3.52653 -0.0003 -0.0003 -0.0003 -2.4656
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Ag -5.94056 -3.53381 -0.14135 -0.0001 -0.0001 -0.0001 -2.3223
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Ag 3.37754 -0.60145 -0.53872 0.0035 0.0035 0.0035 -2.9046
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Ag 6.90915 -0.47027 2.96395 0.0008 0.0008 0.0008 -2.2744
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Ag 1.71440 -1.55022 5.43401 -0.0029 -0.0029 -0.0029 -2.5715
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Ag 1.27207 3.82658 -5.75458 0.0007 0.0007 0.0007 -2.3103
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Ag 3.22580 1.17160 5.52657 -0.0016 -0.0016 -0.0016 -2.4567
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Ag 3.40313 2.83694 3.29422 0.0028 0.0028 0.0028 -2.6865
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Ag 3.30307 2.08782 -1.61184 0.0023 0.0023 0.0023 -2.8977
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Ag -1.56892 -2.35039 1.39672 0.0011 0.0011 0.0011 -2.9197
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Ag 4.65019 3.34749 0.79131 -0.0022 -0.0022 -0.0022 -2.6254
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Ag 0.90722 -0.76474 0.92427 0.0054 0.0054 0.0054 -2.8788
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Ag -3.29488 5.56714 0.40371 0.0005 0.0005 0.0005 -2.3372
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Ag 2.99480 -3.69429 4.09649 0.0007 0.0007 0.0007 -2.5717
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Ag 0.84890 3.43406 -0.94974 -0.0033 -0.0033 -0.0033 -2.8837
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Ag -0.17946 -0.37546 -3.68411 0.0014 0.0014 0.0014 -2.8500
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Ag 3.05067 1.67793 -5.44374 -0.0013 -0.0013 -0.0013 -2.4637
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Ag -1.08435 4.20889 0.86955 -0.0005 -0.0005 -0.0005 -2.7391
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Ag -3.64672 3.07377 -2.93792 -0.0008 -0.0008 -0.0008 -2.5388
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Ag -1.44763 4.85496 -1.68344 -0.0028 -0.0028 -0.0028 -2.5889
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Ag 3.56757 -3.47649 -0.88616 -0.0018 -0.0018 -0.0018 -2.6740
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Ag 0.45123 -4.06965 5.39889 -0.0007 -0.0007 -0.0007 -2.3285
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Ag -4.92318 -3.43266 -2.89340 -0.0006 -0.0006 -0.0006 -2.5748
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Ag -5.55340 1.20684 0.39311 0.0040 0.0040 0.0040 -2.6542
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Ag -0.83021 0.03204 3.04698 -0.0004 -0.0004 -0.0004 -2.9148
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Ag -3.61521 -5.13590 -1.04057 0.0028 0.0028 0.0028 -2.5520
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Ag -5.42343 -1.47078 1.55495 -0.0006 -0.0006 -0.0006 -2.5451
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Ag -1.19935 3.58269 5.09279 -0.0006 -0.0006 -0.0006 -2.5175
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Ag 0.63038 2.81832 3.17739 0.0018 0.0018 0.0018 -2.7705
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Ag 5.74392 1.59569 4.28454 0.0006 0.0006 0.0006 -2.3255
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Ag 3.28098 -4.94800 1.50423 0.0016 0.0016 0.0016 -2.4875
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Ag -1.27632 -3.64348 -1.34085 -0.0017 -0.0017 -0.0017 -2.9096
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Ag 6.85962 1.92699 1.67043 0.0009 0.0009 0.0009 -2.2711
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Ag 1.94426 0.16812 3.22220 0.0020 0.0020 0.0020 -2.9130
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Ag 3.20317 4.96516 -1.13920 -0.0047 -0.0047 -0.0047 -2.5563
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Ag -5.04467 -0.84653 -3.99110 0.0003 0.0003 0.0003 -2.4545
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Ag -4.04097 3.23678 4.61371 -0.0011 -0.0011 -0.0011 -2.3338
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Ag 0.31887 1.05237 5.40338 -0.0011 -0.0011 -0.0011 -2.6648
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Ag -2.49257 0.92841 5.07434 0.0036 0.0036 0.0036 -2.5631
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Ag 5.15792 -1.51433 -2.42575 -0.0000 -0.0000 -0.0000 -2.4236
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Ag -3.62100 -2.31950 -0.56787 -0.0002 -0.0002 -0.0002 -2.8887
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Ag 4.53196 0.55592 1.86943 -0.0012 -0.0012 -0.0012 -2.8989
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Ag -3.91095 -4.04186 1.64336 0.0011 0.0011 0.0011 -2.5076
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Ag 5.42539 -3.31218 2.68906 0.0020 0.0020 0.0020 -2.3161
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Ag 2.92963 -0.09555 -3.32028 -0.0023 -0.0023 -0.0023 -2.7476
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Ag -3.68658 0.27695 -1.85510 0.0012 0.0012 0.0012 -2.8694
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Ag 3.21972 -2.07673 1.77731 0.0021 0.0021 0.0021 -2.8801
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Ag -1.14875 -6.35847 -1.57394 -0.0004 -0.0004 -0.0004 -2.3134
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Ag -6.03811 -1.11228 -1.37785 0.0006 0.0006 0.0006 -2.5618
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Ag -2.72909 5.00239 2.96226 -0.0008 -0.0008 -0.0008 -2.4606
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Ag 0.01686 -3.12814 -3.96812 -0.0017 -0.0017 -0.0017 -2.6460
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Ag 1.03281 -3.56620 0.62213 0.0028 0.0028 0.0028 -2.8983
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Ag -1.05602 -1.56304 5.32398 0.0009 0.0009 0.0009 -2.5725
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Ag -3.53059 -2.78004 -5.24141 -0.0002 -0.0002 -0.0002 -2.2062
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Ag 1.10152 -6.29134 0.31034 -0.0001 -0.0001 -0.0001 -2.3769
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Ag 1.02104 5.12027 -3.12058 0.0015 0.0015 0.0015 -2.5418
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Ag 5.70907 0.87902 -0.71155 -0.0024 -0.0024 -0.0024 -2.6626
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Ag 1.21971 2.36564 -3.51103 0.0033 0.0033 0.0033 -2.8483
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Ag 1.74019 3.59040 5.44677 0.0005 0.0005 0.0005 -2.3315
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Ag -1.28481 1.93292 -2.16526 -0.0009 -0.0009 -0.0009 -2.8980
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Ag -2.52742 -1.87725 -3.17355 -0.0029 -0.0029 -0.0029 -2.7757
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Ag 5.59524 3.56271 -1.87072 0.0006 0.0006 0.0006 -2.3450
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Ag 3.54892 3.83738 -3.81823 0.0025 0.0025 0.0025 -2.5678
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Ag 0.62268 6.14484 -0.48297 -0.0031 -0.0031 -0.0031 -2.3566
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Ag -5.38395 3.95483 -0.78410 -0.0027 -0.0027 -0.0027 -2.3341
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Ag 0.04884 1.21509 -5.91395 -0.0010 -0.0010 -0.0010 -2.5306
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Ag 1.35086 -4.75528 -1.95364 0.0009 0.0009 0.0009 -2.5632
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Ag -3.23714 -1.49163 3.49281 -0.0004 -0.0004 -0.0004 -2.6567
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Ag -2.43442 2.25293 2.55350 -0.0019 -0.0019 -0.0019 -2.8679
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Ag -1.40000 -5.09963 1.09209 0.0005 0.0005 0.0005 -2.6688
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Ag -5.93013 1.62472 -2.31043 0.0008 0.0008 0.0008 -2.3575
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Ag 1.91505 4.56009 1.41699 0.0012 0.0012 0.0012 -2.6581
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Ag -4.73220 0.89449 3.17781 0.0013 0.0013 0.0013 -2.5726
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