89 lines
8.6 KiB
Plaintext
89 lines
8.6 KiB
Plaintext
86
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -1.27124 -0.37391 -0.90679 0.0027 0.0027 0.0027 -2.4920
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Ag -2.46131 2.11710 -0.82998 0.0003 0.0003 0.0003 -2.8102
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Ag -4.25159 -6.61438 -3.21363 -0.0038 -0.0038 -0.0038 -1.9654
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Ag 0.73179 -1.09906 -2.65642 -0.0091 -0.0091 -0.0091 -2.6880
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Ag 6.41912 5.77365 3.27069 -0.0002 -0.0002 -0.0002 -2.0606
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Ag 0.33983 2.53974 6.34366 -0.0008 -0.0008 -0.0008 -2.2871
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Ag -0.79073 -5.85822 -3.22945 0.0016 0.0016 0.0016 -1.7200
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Ag 5.08221 0.96361 7.38414 -0.0003 -0.0003 -0.0003 -1.9741
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Ag -1.71535 6.27658 -1.52151 -0.0012 -0.0012 -0.0012 -2.2043
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Ag 0.55723 6.39879 -2.93625 0.0018 0.0018 0.0018 -2.1222
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Ag -3.93448 -7.22198 0.83167 0.0045 0.0045 0.0045 -2.0097
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Ag 2.30814 -2.80277 2.33524 0.0023 0.0023 0.0023 -2.1694
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Ag -6.38206 -1.41336 -4.92409 0.0001 0.0001 0.0001 -1.6776
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Ag -1.67028 1.33042 4.29432 0.0034 0.0034 0.0034 -2.4047
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Ag 5.41257 2.79732 5.57517 0.0081 0.0081 0.0081 -2.4839
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Ag 2.89977 0.56556 1.81787 -0.0031 -0.0031 -0.0031 -2.7280
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Ag 2.94236 -2.06805 -3.60289 0.0003 0.0003 0.0003 -2.3118
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Ag 0.18532 1.44099 -4.48764 -0.0038 -0.0038 -0.0038 -2.3055
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Ag 4.11067 4.81978 1.21816 -0.0021 -0.0021 -0.0021 -2.3995
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Ag 0.31044 -0.44777 5.89268 -0.0009 -0.0009 -0.0009 -2.3841
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Ag 1.41643 -5.12357 -3.55824 0.0003 0.0003 0.0003 -2.1686
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Ag -5.29607 -5.65809 -0.92457 -0.0081 -0.0081 -0.0081 -2.1099
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Ag -2.36013 -2.00698 0.65480 -0.0013 -0.0013 -0.0013 -2.4629
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Ag -4.37231 -2.74315 -5.93882 0.0054 0.0054 0.0054 -2.2431
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Ag 2.55987 5.89607 3.21043 0.0065 0.0065 0.0065 -2.4221
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Ag 4.49624 0.15066 3.93209 -0.0001 -0.0001 -0.0001 -2.4871
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Ag 1.17602 3.65583 2.60988 -0.0034 -0.0034 -0.0034 -2.6905
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Ag 6.90623 4.75524 5.59967 0.0005 0.0005 0.0005 -2.1203
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Ag 7.85312 3.22903 3.71849 0.0037 0.0037 0.0037 -1.8640
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Ag 5.10093 2.40349 -0.29572 0.0021 0.0021 0.0021 -2.2343
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Ag -2.75180 -6.49225 -1.37930 0.0042 0.0042 0.0042 -2.2489
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Ag 3.73616 -2.23491 0.17310 0.0010 0.0010 0.0010 -2.2649
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Ag -1.78452 -1.35862 -3.12958 0.0054 0.0054 0.0054 -2.5096
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Ag 2.55562 4.43452 5.63982 -0.0030 -0.0030 -0.0030 -2.3770
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Ag 0.86934 -3.05935 4.51660 -0.0079 -0.0079 -0.0079 -2.0148
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Ag 3.31963 0.09505 -0.91307 0.0015 0.0015 0.0015 -2.4618
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Ag 6.07997 2.22899 2.52193 0.0021 0.0021 0.0021 -2.1024
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Ag -5.21446 1.71751 -1.81270 -0.0045 -0.0045 -0.0045 -2.1744
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Ag -4.19854 0.50136 0.70027 -0.0010 -0.0010 -0.0010 -2.6031
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Ag 3.63549 2.86997 3.33687 0.0003 0.0003 0.0003 -2.7814
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Ag 0.27008 -0.88091 3.22804 0.0037 0.0037 0.0037 -2.4338
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Ag 2.90801 1.37844 -3.08958 0.0019 0.0019 0.0019 -2.2929
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Ag 1.28176 3.74980 -3.93183 -0.0023 -0.0023 -0.0023 -2.3472
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Ag -1.36105 -0.75936 -5.71662 -0.0036 -0.0036 -0.0036 -2.3612
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Ag -3.03934 -3.91700 2.27285 -0.0001 -0.0001 -0.0001 -2.0364
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Ag 1.46463 6.80341 0.69309 -0.0068 -0.0068 -0.0068 -2.1009
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Ag -2.27093 -0.23768 2.51197 0.0010 0.0010 0.0010 -2.3885
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Ag -1.31006 -7.27379 0.81521 0.0003 0.0003 0.0003 -2.1123
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Ag -2.01644 -2.75018 -7.18047 0.0009 0.0009 0.0009 -2.1230
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Ag 3.49650 3.64940 -2.36046 -0.0006 -0.0006 -0.0006 -2.2409
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Ag -3.08735 -5.10701 -7.11989 -0.0038 -0.0038 -0.0038 -2.1546
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Ag 0.12770 1.24872 1.34671 0.0000 0.0000 0.0000 -2.8533
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Ag -0.57081 4.30596 4.55584 0.0010 0.0010 0.0010 -2.4042
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Ag 1.10548 1.38193 3.93596 -0.0052 -0.0052 -0.0052 -2.6004
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Ag -2.85538 -4.27980 -4.23351 0.0055 0.0055 0.0055 -2.7288
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Ag 1.83678 5.17849 -1.06277 -0.0004 -0.0004 -0.0004 -2.3566
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Ag -3.12930 4.78097 0.12292 -0.0032 -0.0032 -0.0032 -2.2328
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Ag 4.00836 -4.00104 -2.20468 0.0030 0.0030 0.0030 -2.0025
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Ag -4.18997 -0.48360 -4.75800 -0.0017 -0.0017 -0.0017 -2.0857
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Ag -0.26845 4.07073 0.13163 0.0079 0.0079 0.0079 -2.8018
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Ag -4.59140 -1.68422 2.34581 0.0003 0.0003 0.0003 -2.1034
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Ag -1.06211 -3.82187 -2.17498 0.0002 0.0002 0.0002 -2.3135
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Ag -3.23512 -7.14603 -5.57015 0.0051 0.0051 0.0051 -2.0530
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Ag -1.96312 2.91528 1.93551 -0.0014 -0.0014 -0.0014 -2.7460
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Ag 2.77865 1.32872 5.81947 -0.0024 -0.0024 -0.0024 -2.4597
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Ag -4.03757 2.30725 3.28745 -0.0001 -0.0001 -0.0001 -2.2614
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Ag 1.70660 -3.35932 -1.09762 0.0021 0.0021 0.0021 -2.5709
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Ag -3.58788 -3.41093 -1.53820 0.0033 0.0033 0.0033 -2.5449
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Ag -1.23454 -4.67244 0.29025 0.0014 0.0014 0.0014 -2.4992
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Ag 0.11327 -2.91753 -4.43313 0.0043 0.0043 0.0043 -2.6156
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Ag 1.48309 -1.05832 -5.56670 -0.0007 -0.0007 -0.0007 -2.2073
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Ag 0.63784 1.85444 -1.51846 -0.0028 -0.0028 -0.0028 -2.8281
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Ag 4.67451 6.09500 5.51290 0.0010 0.0010 0.0010 -2.2415
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Ag 3.02664 -1.16130 5.72241 -0.0049 -0.0049 -0.0049 -2.2414
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Ag 0.99248 -1.25923 0.86195 0.0005 0.0005 0.0005 -2.4837
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Ag -0.44098 5.83289 2.25683 -0.0060 -0.0060 -0.0060 -2.4417
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Ag -3.06987 5.12337 3.11975 -0.0041 -0.0041 -0.0041 -2.2148
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Ag -0.77837 -5.84769 -6.10181 0.0023 0.0023 0.0023 -2.1573
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Ag 6.22339 -0.75987 6.04351 -0.0078 -0.0078 -0.0078 -1.7992
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Ag 5.79736 5.27977 7.94037 -0.0006 -0.0006 -0.0006 -1.7429
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Ag 0.26022 -6.65592 -1.24147 -0.0033 -0.0033 -0.0033 -2.1548
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Ag -4.71623 3.30789 0.93403 0.0042 0.0042 0.0042 -2.1528
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Ag 2.58759 2.93571 0.36756 0.0028 0.0028 0.0028 -2.7396
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Ag -3.76258 4.04259 -2.28890 0.0033 0.0033 0.0033 -2.2337
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Ag -3.93890 -0.59819 -1.77882 0.0041 0.0041 0.0041 -2.4875
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Ag -0.89376 4.00669 -2.48187 -0.0030 -0.0030 -0.0030 -2.5243
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