63 lines
6.0 KiB
Plaintext
63 lines
6.0 KiB
Plaintext
60
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -6.42202 -6.18312 2.32473 -0.0013 -0.0013 -0.0013 -2.7222
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Ag -6.01400 -3.61848 1.45772 0.0002 0.0002 0.0002 -2.8849
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Ag -6.45839 -4.11975 4.38197 0.0024 0.0024 0.0024 -2.8536
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Ag -6.31594 -8.22718 0.34940 -0.0001 -0.0001 -0.0001 -2.7720
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Ag -7.04071 -8.97621 3.01172 -0.0022 -0.0022 -0.0022 -2.7641
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Ag -8.54619 -4.32063 2.36166 0.0006 0.0006 0.0006 -2.8678
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Ag -4.07098 -4.97474 3.26848 0.0029 0.0029 0.0029 -2.8361
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Ag -8.70858 -7.37924 1.56499 0.0010 0.0010 0.0010 -2.7926
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Ag -4.39052 -8.08597 2.48528 0.0015 0.0015 0.0015 -2.8486
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Ag -7.37623 -5.53290 -0.11205 0.0036 0.0036 0.0036 -2.8774
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Ag -4.39758 -5.83380 0.50535 -0.0025 -0.0025 -0.0025 -2.8897
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Ag -8.35768 -6.53644 4.24263 0.0000 0.0000 0.0000 -2.7937
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Ag -5.74717 -7.06559 4.68735 0.0008 0.0008 0.0008 -2.7826
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Ag -5.22916 -0.96472 0.80946 -0.0021 -0.0021 -0.0021 -2.2661
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Ag -6.19721 -2.08893 6.45573 0.0011 0.0011 0.0011 -2.2385
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Ag -5.97043 -10.08875 -1.34489 0.0001 0.0001 0.0001 -2.2962
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Ag -7.28021 -11.24202 4.29358 -0.0015 -0.0015 -0.0015 -2.2688
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Ag -12.46765 -6.58084 -0.67747 -0.0009 -0.0009 -0.0009 -2.3787
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Ag -1.71744 -4.06501 3.95115 0.0013 0.0013 0.0013 -2.3074
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Ag -10.98596 -8.41836 0.92973 0.0005 0.0005 0.0005 -2.5100
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Ag -2.03472 -9.39226 2.91779 0.0011 0.0011 0.0011 -2.2483
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Ag -6.96914 -3.00759 -1.12314 -0.0037 -0.0037 -0.0037 -2.4798
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Ag -2.14654 -5.19976 -1.08903 0.0013 0.0013 0.0013 -2.1542
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Ag -7.80249 -1.47357 1.83526 0.0006 0.0006 0.0006 -2.3978
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Ag -4.73965 -7.39119 7.36042 -0.0002 -0.0002 -0.0002 -2.3251
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Ag -12.28884 -3.85549 -0.01761 0.0018 0.0018 0.0018 -2.3789
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Ag -10.72063 -5.62265 1.33136 0.0002 0.0002 0.0002 -2.8616
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Ag -12.75387 -4.32236 2.71291 0.0019 0.0019 0.0019 -2.2790
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Ag -3.53122 -2.55178 2.17715 -0.0021 -0.0021 -0.0021 -2.5648
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Ag -5.82404 -1.69888 3.47840 0.0011 0.0011 0.0011 -2.5208
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Ag -9.48188 -3.73780 -0.31663 -0.0010 -0.0010 -0.0010 -2.6816
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Ag -11.07437 -4.88897 -2.27421 0.0021 0.0021 0.0021 -2.2653
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Ag -4.10080 -3.29492 -0.55819 0.0008 0.0008 0.0008 -2.5448
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Ag -1.99875 -4.69318 1.36410 -0.0018 -0.0018 -0.0018 -2.4651
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Ag -5.50474 -5.31249 -2.11551 -0.0027 -0.0027 -0.0027 -2.5270
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Ag -8.23079 -2.01045 4.66874 -0.0005 -0.0005 -0.0005 -2.3782
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Ag -10.73535 -7.49161 3.62492 -0.0031 -0.0031 -0.0031 -2.6429
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Ag -10.53973 -4.73021 4.21475 -0.0017 -0.0017 -0.0017 -2.6031
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Ag -3.91985 -2.96008 5.28351 -0.0006 -0.0006 -0.0006 -2.5180
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Ag -7.46822 -7.14776 6.85674 -0.0022 -0.0022 -0.0022 -2.5580
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Ag -2.21331 -7.48876 0.72066 0.0008 0.0008 0.0008 -2.5208
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Ag -8.56969 -9.40667 -0.35242 0.0004 0.0004 0.0004 -2.5768
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Ag -6.84473 -10.93275 1.20999 -0.0006 -0.0006 -0.0006 -2.5503
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Ag -1.82100 -6.64173 3.37976 -0.0010 -0.0010 -0.0010 -2.5489
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Ag -4.13367 -10.05032 0.56173 -0.0005 -0.0005 -0.0005 -2.4846
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Ag -9.77097 -7.00387 -1.15670 -0.0030 -0.0030 -0.0030 -2.7073
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Ag -10.62227 -2.66079 2.10939 0.0017 0.0017 0.0017 -2.4247
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Ag -4.30782 -7.79508 -1.54195 -0.0024 -0.0024 -0.0024 -2.4830
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Ag -3.18231 -5.65596 5.73344 -0.0013 -0.0013 -0.0013 -2.5589
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Ag -8.93420 -9.15841 5.04575 -0.0032 -0.0032 -0.0032 -2.5312
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Ag -9.31650 -10.06522 2.37259 0.0016 0.0016 0.0016 -2.5150
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Ag -5.81212 -9.29673 6.01011 0.0028 0.0028 0.0028 -2.4154
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Ag -4.79167 -10.64780 3.26162 -0.0013 -0.0013 -0.0013 -2.4651
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Ag -13.05807 -7.00017 1.95785 -0.0030 -0.0030 -0.0030 -2.2705
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Ag -3.06698 -8.33037 5.36169 -0.0023 -0.0023 -0.0023 -2.4318
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Ag -8.27150 -5.03327 -2.62124 0.0008 0.0008 0.0008 -2.4447
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Ag -7.19270 -7.63585 -2.14343 0.0025 0.0025 0.0025 -2.5636
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Ag -10.10190 -6.63602 6.34991 0.0008 0.0008 0.0008 -2.3023
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Ag -5.66329 -4.82883 6.82181 0.0002 0.0002 0.0002 -2.5504
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Ag -8.53471 -4.53991 6.09667 0.0024 0.0024 0.0024 -2.5100
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