82 lines
7.9 KiB
Plaintext
82 lines
7.9 KiB
Plaintext
79
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -49.70908 -51.33114 1.76564 -0.0015 -0.0015 -0.0015 -2.9443
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Ag -50.60499 -48.61303 1.61854 0.0011 0.0011 0.0011 -2.9184
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Ag -50.43071 -48.50759 4.41345 0.0012 0.0012 0.0012 -2.9288
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Ag -48.43386 -53.53111 2.94434 0.0004 0.0004 0.0004 -2.8312
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Ag -50.05133 -54.12662 0.88463 0.0016 0.0016 0.0016 -2.9130
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Ag -53.19122 -49.56498 0.82290 -0.0009 -0.0009 -0.0009 -2.9309
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Ag -48.08505 -49.25637 2.96148 -0.0002 -0.0002 -0.0002 -2.8957
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Ag -51.27969 -53.19410 -1.57307 -0.0039 -0.0039 -0.0039 -2.9261
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Ag -49.38126 -51.06902 4.76918 0.0014 0.0014 0.0014 -2.9385
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Ag -51.84096 -47.70905 -0.86062 -0.0012 -0.0012 -0.0012 -2.6584
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Ag -48.18344 -49.22318 0.27639 -0.0001 -0.0001 -0.0001 -2.8196
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Ag -52.34775 -52.45594 0.89322 -0.0015 -0.0015 -0.0015 -2.8700
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Ag -50.94156 -53.09128 3.62326 -0.0012 -0.0012 -0.0012 -2.8492
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Ag -51.53100 -46.07034 1.39591 -0.0018 -0.0018 -0.0018 -2.4729
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Ag -52.01120 -50.47099 5.99213 -0.0006 -0.0006 -0.0006 -2.6469
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Ag -45.43040 -53.42663 2.72224 -0.0005 -0.0005 -0.0005 -2.5471
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Ag -46.28774 -54.99346 -2.03245 -0.0012 -0.0012 -0.0012 -2.3679
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Ag -56.56185 -48.02739 -0.24789 -0.0013 -0.0013 -0.0013 -2.2368
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Ag -51.17363 -45.87606 6.92775 0.0033 0.0033 0.0033 -2.1196
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Ag -49.45852 -48.39186 -2.16575 -0.0005 -0.0005 -0.0005 -2.5476
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Ag -46.93256 -51.61415 6.69380 0.0011 0.0011 0.0011 -2.3048
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Ag -47.03713 -47.58636 -1.49957 0.0005 0.0005 0.0005 -2.2753
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Ag -45.14995 -49.35185 2.84417 -0.0025 -0.0025 -0.0025 -2.5797
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Ag -54.73904 -53.33048 0.20079 0.0004 0.0004 0.0004 -2.5470
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Ag -50.98206 -52.95515 6.31953 -0.0007 -0.0007 -0.0007 -2.5024
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Ag -52.84341 -47.73140 3.21157 -0.0003 -0.0003 -0.0003 -2.7437
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Ag -49.11488 -46.70958 0.12085 0.0014 0.0014 0.0014 -2.5528
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Ag -55.48402 -48.85034 2.20314 -0.0024 -0.0024 -0.0024 -2.4720
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Ag -48.86652 -46.50515 5.67546 -0.0035 -0.0035 -0.0035 -2.4802
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Ag -48.92976 -46.54184 2.86939 -0.0018 -0.0018 -0.0018 -2.6763
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Ag -45.44406 -49.37584 0.05461 -0.0031 -0.0031 -0.0031 -2.5576
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Ag -54.49095 -48.81419 -1.83079 0.0007 0.0007 0.0007 -2.6368
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Ag -46.43256 -47.15586 1.54239 -0.0015 -0.0015 -0.0015 -2.4907
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Ag -47.83913 -49.03146 6.06691 0.0011 0.0011 0.0011 -2.6624
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Ag -47.38717 -52.68578 -3.14235 0.0018 0.0018 0.0018 -2.4379
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Ag -54.58463 -51.56200 2.36482 -0.0012 -0.0012 -0.0012 -2.6765
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Ag -53.34742 -51.32177 -1.44738 -0.0000 -0.0000 -0.0000 -2.8883
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Ag -53.33588 -54.03282 2.87585 0.0024 0.0024 0.0024 -2.5232
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Ag -53.45740 -52.41806 4.90405 0.0000 0.0000 0.0000 -2.5275
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Ag -51.49833 -55.92533 -2.48471 0.0010 0.0010 0.0010 -2.4532
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Ag -49.05914 -55.02067 -1.77733 -0.0033 -0.0033 -0.0033 -2.7096
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Ag -50.82865 -50.34795 -0.67484 0.0026 0.0026 0.0026 -2.9180
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Ag -49.79838 -51.06437 -3.14393 -0.0019 -0.0019 -0.0019 -2.6452
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Ag -45.51195 -55.96398 2.20799 -0.0015 -0.0015 -0.0015 -2.2585
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Ag -48.48111 -56.15180 2.20617 0.0012 0.0012 0.0012 -2.6395
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Ag -52.13964 -49.56761 -3.18577 0.0007 0.0007 0.0007 -2.5301
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Ag -52.43299 -54.84386 -4.69414 0.0002 0.0002 0.0002 -2.1195
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Ag -44.10155 -51.47965 1.30398 0.0009 0.0009 0.0009 -2.3196
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Ag -46.80471 -51.32502 1.43229 0.0047 0.0047 0.0047 -2.8531
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Ag -48.68924 -52.19381 -0.81828 -0.0001 -0.0001 -0.0001 -2.9192
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Ag -52.74159 -55.31350 -0.06719 0.0014 0.0014 0.0014 -2.5929
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Ag -51.41516 -55.98576 2.47169 -0.0003 -0.0003 -0.0003 -2.5183
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Ag -48.41823 -53.54164 5.79727 -0.0009 -0.0009 -0.0009 -2.3850
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Ag -47.12457 -50.09246 -2.13946 -0.0002 -0.0002 -0.0002 -2.5490
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Ag -49.47577 -51.05735 7.48247 -0.0002 -0.0002 -0.0002 -2.4162
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Ag -49.63568 -55.38865 4.75218 -0.0001 -0.0001 -0.0001 -2.4229
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Ag -45.78339 -52.30602 -1.04865 -0.0021 -0.0021 -0.0021 -2.6425
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Ag -54.16083 -46.99278 0.62446 -0.0022 -0.0022 -0.0022 -2.4548
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Ag -47.55401 -56.85052 -0.34533 0.0015 0.0015 0.0015 -2.3208
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Ag -47.20151 -54.16685 0.55479 0.0032 0.0032 0.0032 -2.9077
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Ag -55.65449 -50.54714 0.01997 0.0020 0.0020 0.0020 -2.6718
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Ag -50.36560 -48.46377 7.21132 0.0012 0.0012 0.0012 -2.4965
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Ag -50.04668 -53.74715 -3.95287 -0.0014 -0.0014 -0.0014 -2.4790
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Ag -46.66446 -55.14367 4.54719 -0.0005 -0.0005 -0.0005 -2.3446
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Ag -46.73845 -51.45140 4.05512 0.0004 0.0004 0.0004 -2.7041
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Ag -50.31678 -56.76006 -0.06347 0.0040 0.0040 0.0040 -2.4748
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Ag -51.24150 -45.80219 4.25438 -0.0013 -0.0013 -0.0013 -2.4667
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Ag -44.52588 -54.45386 0.14222 0.0009 0.0009 0.0009 -2.3293
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Ag -45.27278 -49.51872 5.58047 -0.0010 -0.0010 -0.0010 -2.2306
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Ag -51.97263 -50.50592 3.27862 0.0001 0.0001 0.0001 -2.9183
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Ag -54.31193 -49.74640 4.61378 0.0008 0.0008 0.0008 -2.4848
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Ag -52.30296 -54.96347 5.29886 0.0014 0.0014 0.0014 -2.3153
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Ag -54.82035 -50.74523 -4.08076 -0.0018 -0.0018 -0.0018 -2.3102
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Ag -52.73444 -47.74057 5.95837 0.0000 0.0000 0.0000 -2.4508
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Ag -55.75366 -52.37444 -2.18699 -0.0002 -0.0002 -0.0002 -2.3951
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Ag -53.71220 -54.17345 -2.35579 -0.0012 -0.0012 -0.0012 -2.5832
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Ag -46.61054 -47.43475 4.25493 0.0000 0.0000 0.0000 -2.4773
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Ag -52.53731 -52.27259 -4.04805 0.0017 0.0017 0.0017 -2.5588
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Ag -56.85234 -49.91144 -2.43448 0.0029 0.0029 0.0029 -2.2341
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