92 lines
8.9 KiB
Plaintext
92 lines
8.9 KiB
Plaintext
89
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -2.19187 2.03595 -0.26573 0.0008 0.0008 0.0008 -2.9186
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Ag 4.20178 -2.39202 2.52497 0.0002 0.0002 0.0002 -2.5674
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Ag -3.57817 2.67675 2.04426 -0.0023 -0.0023 -0.0023 -2.7479
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Ag -3.82168 3.65775 -1.98846 0.0011 0.0011 0.0011 -2.5517
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Ag -0.33379 1.97555 6.02068 0.0011 0.0011 0.0011 -2.5229
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Ag -3.48782 5.40590 2.87295 0.0005 0.0005 0.0005 -2.3831
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Ag -2.12297 0.78082 3.57201 0.0003 0.0003 0.0003 -2.8536
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Ag -2.00872 3.58210 4.35270 -0.0074 -0.0074 -0.0074 -2.6762
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Ag 3.17670 -0.17695 -3.60838 -0.0010 -0.0010 -0.0010 -2.8434
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Ag -6.20806 2.77717 2.29176 -0.0030 -0.0030 -0.0030 -2.3437
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Ag 1.37690 -1.31103 -5.79494 0.0016 0.0016 0.0016 -2.6213
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Ag 0.65653 1.00250 -4.15101 -0.0003 -0.0003 -0.0003 -2.9176
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Ag 5.41658 1.15432 -4.08545 0.0010 0.0010 0.0010 -2.3472
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Ag 2.31655 1.95542 -1.88378 -0.0021 -0.0021 -0.0021 -2.7984
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Ag 1.80105 4.34448 1.60389 0.0014 0.0014 0.0014 -2.6627
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Ag -1.93358 -4.00860 3.72497 -0.0004 -0.0004 -0.0004 -2.6013
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Ag 1.26308 -3.89756 -4.75125 0.0013 0.0013 0.0013 -2.3950
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Ag 0.16091 -2.08066 -0.27163 -0.0013 -0.0013 -0.0013 -2.9416
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Ag -4.91223 2.03051 -0.00892 -0.0021 -0.0021 -0.0021 -2.5374
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Ag 0.04318 0.65114 -1.34201 0.0011 0.0011 0.0011 -2.9075
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Ag -1.07991 0.10183 -6.30831 0.0005 0.0005 0.0005 -2.4678
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Ag 1.01382 -4.23479 -1.99797 -0.0014 -0.0014 -0.0014 -2.7173
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Ag 4.38831 3.29884 -2.65363 0.0012 0.0012 0.0012 -2.3710
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Ag 1.98754 -2.71824 4.27808 -0.0001 -0.0001 -0.0001 -2.6735
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Ag 3.44915 -2.62603 -2.22886 -0.0015 -0.0015 -0.0015 -2.8192
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Ag 0.86404 -1.56790 -2.97337 -0.0002 -0.0002 -0.0002 -2.9272
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Ag -4.98589 4.56044 0.58447 0.0006 0.0006 0.0006 -2.3527
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Ag 1.15444 -0.45583 6.00328 -0.0007 -0.0007 -0.0007 -2.5409
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Ag -0.57436 2.97700 -5.61599 0.0004 0.0004 0.0004 -2.4980
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Ag -1.99697 -2.34747 1.51221 0.0025 0.0025 0.0025 -2.9052
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Ag -4.14025 -2.02358 -3.26277 -0.0028 -0.0028 -0.0028 -2.2925
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Ag -4.83454 3.46698 4.39711 0.0008 0.0008 0.0008 -2.3610
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Ag 0.37218 6.10360 0.14594 0.0006 0.0006 0.0006 -2.3625
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Ag -5.07873 -0.95593 -0.83199 -0.0014 -0.0014 -0.0014 -2.5594
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Ag -6.39539 -0.09254 1.45520 -0.0013 -0.0013 -0.0013 -2.3419
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Ag 3.33519 -0.14488 4.19665 0.0015 0.0015 0.0015 -2.5773
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Ag -0.34233 -3.05344 5.90292 0.0032 0.0032 0.0032 -2.3717
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Ag 0.74561 -5.11128 4.41386 0.0029 0.0029 0.0029 -2.3501
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Ag 0.96604 3.84951 4.29472 0.0013 0.0013 0.0013 -2.5610
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Ag -3.06311 1.67309 -5.12850 0.0006 0.0006 0.0006 -2.3918
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Ag -3.51379 -4.88844 1.41015 0.0002 0.0002 0.0002 -2.3289
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Ag 4.14155 0.28369 1.44338 -0.0000 -0.0000 -0.0000 -2.6808
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Ag 3.85910 -2.52418 -5.13322 0.0002 0.0002 0.0002 -2.4247
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Ag -3.37697 1.58612 5.83576 -0.0017 -0.0017 -0.0017 -2.3690
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Ag 1.25852 -5.65678 0.46555 0.0035 0.0035 0.0035 -2.4969
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Ag 0.80055 1.01812 3.59588 0.0005 0.0005 0.0005 -2.9334
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Ag 2.68799 -3.19181 0.38137 -0.0004 -0.0004 -0.0004 -2.8897
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Ag 1.81340 -1.05014 2.02493 0.0003 0.0003 0.0003 -2.9083
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Ag -3.75393 -3.31831 -0.83503 0.0011 0.0011 0.0011 -2.5561
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Ag -0.86875 -2.37234 -5.11640 0.0020 0.0020 0.0020 -2.3174
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Ag 3.67330 -4.83146 -3.84153 0.0020 0.0020 0.0020 -2.3053
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Ag 5.07198 -4.43022 0.79224 0.0005 0.0005 0.0005 -2.3830
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Ag -1.52630 2.31046 -3.03229 0.0026 0.0026 0.0026 -2.8311
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Ag 3.90079 2.86106 0.24132 0.0002 0.0002 0.0002 -2.5364
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Ag -0.96203 -6.09354 2.09378 -0.0017 -0.0017 -0.0017 -2.3393
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Ag -0.50122 -1.51364 3.67402 -0.0003 -0.0003 -0.0003 -2.8740
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Ag 5.67057 -4.07068 -1.97844 0.0022 0.0022 0.0022 -2.3408
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Ag 2.67805 4.92718 -0.94791 -0.0030 -0.0030 -0.0030 -2.4073
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Ag 1.66347 1.59768 0.99266 0.0002 0.0002 0.0002 -2.9001
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Ag 0.96130 3.81561 -3.40815 -0.0029 -0.0029 -0.0029 -2.6149
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Ag 2.99255 2.37319 -4.84039 -0.0006 -0.0006 -0.0006 -2.5824
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Ag -3.57764 0.04710 1.42403 -0.0005 -0.0005 -0.0005 -2.8193
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Ag -4.74821 -2.28571 1.79934 -0.0006 -0.0006 -0.0006 -2.4946
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Ag 5.80101 -1.19237 -2.76614 -0.0023 -0.0023 -0.0023 -2.4140
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Ag 1.38485 1.33848 -6.88593 0.0007 0.0007 0.0007 -2.3622
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Ag -1.48952 -2.90912 -2.40849 0.0012 0.0012 0.0012 -2.6850
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Ag 2.59917 -0.52047 -0.71986 0.0017 0.0017 0.0017 -2.9221
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Ag -3.80189 1.00787 -2.40924 0.0020 0.0020 0.0020 -2.6447
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Ag 3.01041 -4.78404 2.69566 -0.0021 -0.0021 -0.0021 -2.4776
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Ag 3.32828 2.53563 3.17816 -0.0009 -0.0009 -0.0009 -2.5465
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Ag -0.72094 0.09005 1.31629 -0.0013 -0.0013 -0.0013 -2.9235
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Ag 5.16510 -1.77684 -0.12924 -0.0038 -0.0038 -0.0038 -2.6579
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Ag -0.55931 2.93627 2.08307 0.0030 0.0030 0.0030 -2.9007
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Ag -2.15295 4.72044 0.39369 0.0007 0.0007 0.0007 -2.7568
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Ag -1.68390 -0.61218 6.06441 -0.0028 -0.0028 -0.0028 -2.4942
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Ag 3.45800 -5.42807 -1.18373 0.0003 0.0003 0.0003 -2.4731
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Ag -1.96102 -0.53375 -3.75063 0.0004 0.0004 0.0004 -2.6876
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Ag 0.25474 3.43228 -0.61489 0.0017 0.0017 0.0017 -2.9053
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Ag -2.63644 4.35865 -4.38499 -0.0009 -0.0009 -0.0009 -2.2701
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Ag 2.50165 2.08526 5.80934 0.0004 0.0004 0.0004 -2.3121
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Ag -1.19237 5.14495 -2.21669 -0.0017 -0.0017 -0.0017 -2.4696
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Ag -2.36228 -0.84569 -0.91045 -0.0011 -0.0011 -0.0011 -2.8968
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Ag -0.70950 5.52568 2.62672 0.0008 0.0008 0.0008 -2.4682
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Ag -4.98430 0.68187 3.71057 -0.0004 -0.0004 -0.0004 -2.6220
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Ag 3.78557 0.11798 -6.27747 0.0014 0.0014 0.0014 -2.3650
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Ag -1.33392 -4.64009 -0.24843 0.0005 0.0005 0.0005 -2.6440
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Ag 0.43629 -3.55352 2.13493 -0.0023 -0.0023 -0.0023 -2.8891
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Ag -3.31490 -1.64910 3.92620 -0.0011 -0.0011 -0.0011 -2.6013
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Ag 5.30863 1.08782 -1.03971 0.0037 0.0037 0.0037 -2.5064
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