102 lines
9.9 KiB
Plaintext
102 lines
9.9 KiB
Plaintext
99
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Ag Ag pos(A), vel, pot-en(eV)
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Ag 1.04559 -0.10631 1.49869 0.0023 0.0023 0.0023 -2.6220
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Ag -1.49396 0.41382 3.00986 -0.0015 -0.0015 -0.0015 -2.6274
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Ag -2.43389 -1.69248 -4.52557 0.0021 0.0021 0.0021 -2.6468
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Ag -1.24953 -2.64607 0.61712 -0.0030 -0.0030 -0.0030 -2.6982
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Ag -0.53577 -5.54624 0.17248 -0.0009 -0.0009 -0.0009 -2.4871
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Ag 1.14070 -3.51467 1.47407 -0.0023 -0.0023 -0.0023 -2.7167
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Ag 2.35556 4.28992 -0.77294 0.0009 0.0009 0.0009 -2.4296
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Ag 2.69382 -4.43147 -0.42428 -0.0033 -0.0033 -0.0033 -2.4360
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Ag -4.29850 -5.65257 -5.37145 -0.0038 -0.0038 -0.0038 -2.2689
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Ag 3.47711 -0.90890 0.75314 -0.0037 -0.0037 -0.0037 -2.6728
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Ag 1.30853 -3.56565 -5.69478 0.0019 0.0019 0.0019 -2.1724
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Ag 5.28654 3.55263 -4.37229 -0.0066 -0.0066 -0.0066 -1.7790
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Ag 2.85992 4.16104 -3.57409 0.0018 0.0018 0.0018 -2.1134
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Ag -4.66658 -3.23885 -6.17179 -0.0015 -0.0015 -0.0015 -2.2394
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Ag -2.68416 2.70762 4.36919 -0.0021 -0.0021 -0.0021 -2.4299
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Ag 1.24405 -2.10116 -0.99124 0.0013 0.0013 0.0013 -2.8110
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Ag -2.93417 -1.48812 2.67971 -0.0006 -0.0006 -0.0006 -2.5059
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Ag 3.43272 1.26206 -6.23902 0.0034 0.0034 0.0034 -2.1069
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Ag 4.81431 7.54130 3.12652 -0.0024 -0.0024 -0.0024 -1.4480
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Ag 4.78935 3.79763 -0.33224 -0.0015 -0.0015 -0.0015 -2.3479
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Ag 1.01277 -0.13431 4.10015 0.0061 0.0061 0.0061 -2.4815
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Ag -2.47166 2.42282 -1.50864 0.0041 0.0041 0.0041 -2.7739
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Ag -1.09264 1.01861 -6.53352 0.0004 0.0004 0.0004 -1.9666
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Ag 0.27689 -6.24511 3.16180 0.0071 0.0071 0.0071 -2.2698
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Ag -0.92150 4.16802 3.12922 0.0002 0.0002 0.0002 -2.3851
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Ag -1.78371 -3.85359 -6.18254 0.0021 0.0021 0.0021 -2.3193
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Ag 2.10465 -4.88797 -3.01045 -0.0030 -0.0030 -0.0030 -2.3912
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Ag 4.97049 -0.72558 2.87188 0.0028 0.0028 0.0028 -2.3876
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Ag 1.83472 0.47065 -2.13915 0.0010 0.0010 0.0010 -2.6818
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Ag -3.10295 -3.13651 4.59875 0.0011 0.0011 0.0011 -2.2414
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Ag -2.01443 5.93607 -2.71773 0.0017 0.0017 0.0017 -2.0381
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Ag 4.93649 -3.17680 0.09883 0.0000 0.0000 0.0000 -2.2722
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Ag -0.27588 4.16986 -4.03433 0.0046 0.0046 0.0046 -2.3388
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Ag 4.81682 -3.28922 2.97646 0.0030 0.0030 0.0030 -2.1220
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Ag -0.95771 -4.53842 5.18387 0.0057 0.0057 0.0057 -2.3892
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Ag -5.91688 -1.07637 -5.04939 0.0057 0.0057 0.0057 -2.1548
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Ag 0.86603 2.41945 5.16209 -0.0047 -0.0047 -0.0047 -2.1561
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Ag -4.43760 -1.04751 0.18219 -0.0006 -0.0006 -0.0006 -2.5329
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Ag -3.37782 0.13554 5.12530 -0.0020 -0.0020 -0.0020 -2.4839
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Ag -1.05307 -0.74513 -1.82821 0.0012 0.0012 0.0012 -2.6712
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Ag 5.74986 1.73151 1.61602 -0.0043 -0.0043 -0.0043 -2.4231
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Ag 0.08210 -6.67371 -2.01366 -0.0066 -0.0066 -0.0066 -2.2549
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Ag 0.99789 -0.57496 -5.75229 0.0009 0.0009 0.0009 -2.3818
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Ag 2.94285 6.57740 0.51797 -0.0032 -0.0032 -0.0032 -2.2725
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Ag 2.73828 -5.66031 2.05661 -0.0006 -0.0006 -0.0006 -2.2350
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Ag -2.34609 5.60018 0.26053 0.0039 0.0039 0.0039 -2.4149
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Ag 3.82576 4.04713 5.19076 0.0009 0.0009 0.0009 -1.9879
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Ag 3.04673 1.20185 2.61617 0.0078 0.0078 0.0078 -2.6621
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Ag 7.17619 2.48502 -0.37425 0.0099 0.0099 0.0099 -1.8900
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Ag 0.06970 1.71324 -0.57323 -0.0003 -0.0003 -0.0003 -2.7834
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Ag 1.54074 -4.44037 4.11970 0.0023 0.0023 0.0023 -2.3541
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Ag 6.20538 3.52189 5.41851 -0.0028 -0.0028 -0.0028 -1.6863
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Ag 0.39698 -2.11021 -3.69398 -0.0018 -0.0018 -0.0018 -2.6392
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Ag 1.99769 6.62787 3.03757 -0.0059 -0.0059 -0.0059 -2.2454
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Ag 3.42918 -2.47506 -2.57066 -0.0006 -0.0006 -0.0006 -2.4641
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Ag 6.49607 -0.50507 0.18562 0.0005 0.0005 0.0005 -2.2109
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Ag -5.45889 -5.70222 -2.98677 0.0027 0.0027 0.0027 -2.1492
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Ag -2.93379 3.93111 -3.79603 0.0070 0.0070 0.0070 -2.1385
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Ag -4.67019 2.39948 5.90545 0.0052 0.0052 0.0052 -1.9471
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Ag -2.20920 -6.85827 -3.84021 0.0009 0.0009 0.0009 -2.2223
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Ag -0.34004 4.45503 -1.12743 -0.0039 -0.0039 -0.0039 -2.6074
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Ag -0.89676 -0.74260 5.97502 -0.0031 -0.0031 -0.0031 -2.2668
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Ag -6.51447 -3.78640 -4.51989 -0.0002 -0.0002 -0.0002 -2.2137
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Ag 0.52771 2.17586 2.41789 -0.0025 -0.0025 -0.0025 -2.5711
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Ag 1.82927 8.62914 1.35841 -0.0029 -0.0029 -0.0029 -1.8727
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Ag -1.80455 2.93733 1.01634 -0.0030 -0.0030 -0.0030 -2.7339
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Ag -2.45574 -6.41114 4.10480 0.0010 0.0010 0.0010 -1.9731
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Ag 2.95770 1.66425 -0.05438 -0.0016 -0.0016 -0.0016 -2.7582
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Ag -1.18535 6.83667 2.69755 -0.0016 -0.0016 -0.0016 -2.1587
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Ag 1.56794 2.42733 -4.62657 0.0002 0.0002 0.0002 -2.1979
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Ag -2.65775 -2.68777 -1.43953 -0.0017 -0.0017 -0.0017 -2.3984
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Ag -5.29724 1.94464 -2.99763 -0.0003 -0.0003 -0.0003 -2.1737
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Ag -2.28251 0.28628 0.39484 -0.0006 -0.0006 -0.0006 -2.7307
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Ag 4.44844 -0.29571 -1.76187 -0.0010 -0.0010 -0.0010 -2.4526
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Ag -6.54579 -0.38054 -2.43599 -0.0052 -0.0052 -0.0052 -2.1460
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Ag 1.06883 -2.36553 6.17618 0.0015 0.0015 0.0015 -2.2358
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Ag 2.79107 -2.13063 4.16919 0.0008 0.0008 0.0008 -2.4881
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Ag 5.15386 4.02246 2.78155 0.0032 0.0032 0.0032 -2.3218
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Ag 3.95796 -1.04871 -4.86876 0.0057 0.0057 0.0057 -2.2079
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Ag -4.90180 -2.51283 -2.53884 -0.0023 -0.0023 -0.0023 -2.5578
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Ag 3.64198 0.91044 5.23619 0.0011 0.0011 0.0011 -2.1346
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Ag 3.71803 1.40718 -3.69189 -0.0035 -0.0035 -0.0035 -2.4137
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Ag -5.64171 -0.86687 3.54196 0.0036 0.0036 0.0036 -1.9590
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Ag -2.71356 -5.84122 -1.40113 0.0033 0.0033 0.0033 -2.5231
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Ag -1.61666 -4.35148 2.61029 0.0066 0.0066 0.0066 -2.6436
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Ag 2.54076 3.86301 1.76149 -0.0037 -0.0037 -0.0037 -2.6727
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Ag -3.35046 5.13141 2.75728 0.0004 0.0004 0.0004 -2.3592
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Ag -2.93165 -4.26953 -3.64484 0.0003 0.0003 0.0003 -2.7292
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Ag -0.20782 -2.20356 3.52454 0.0007 0.0007 0.0007 -2.7373
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Ag -0.48132 -4.13222 -2.19145 0.0012 0.0012 0.0012 -2.7662
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Ag -4.38381 0.79971 2.17761 0.0028 0.0028 0.0028 -2.5202
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Ag -0.52911 1.07728 -3.60877 -0.0016 -0.0016 -0.0016 -2.6639
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Ag -0.34913 -5.63661 -4.86076 -0.0002 -0.0002 -0.0002 -2.3003
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Ag -4.65517 3.00375 0.51350 -0.0080 -0.0080 -0.0080 -2.2285
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Ag -5.43529 3.16937 3.40410 0.0038 0.0038 0.0038 -2.1787
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Ag -2.90024 1.50867 -4.52585 -0.0007 -0.0007 -0.0007 -2.3389
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Ag 0.55661 5.61329 1.32114 -0.0026 -0.0026 -0.0026 -2.4502
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Ag -3.66183 -0.09945 -2.49653 -0.0032 -0.0032 -0.0032 -2.7387
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Ag -3.95947 -3.95209 0.41350 -0.0008 -0.0008 -0.0008 -2.2751
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