80 lines
7.7 KiB
Plaintext
80 lines
7.7 KiB
Plaintext
77
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -1.66169 4.34159 4.08584 -0.0024 -0.0024 -0.0024 -2.1994
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Ag -6.02938 3.40896 -0.03227 0.0007 0.0007 0.0007 -2.2242
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Ag 2.21592 -2.40676 3.58134 0.0003 0.0003 0.0003 -2.4166
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Ag -5.57055 0.61832 0.05766 0.0026 0.0026 0.0026 -2.5165
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Ag -4.32184 -4.59071 -7.07588 0.0017 0.0017 0.0017 -1.8596
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Ag -1.65131 -7.89168 -3.23860 0.0043 0.0043 0.0043 -1.7710
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Ag 3.52718 -4.14705 -2.26691 -0.0061 -0.0061 -0.0061 -2.3049
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Ag 1.69857 0.78125 0.80882 -0.0009 -0.0009 -0.0009 -2.6159
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Ag 3.75081 4.28932 0.25142 0.0035 0.0035 0.0035 -1.9032
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Ag 3.57835 3.60789 2.68947 0.0010 0.0010 0.0010 -2.3640
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Ag -5.41558 0.14653 -2.93082 0.0011 0.0011 0.0011 -2.3250
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Ag 0.74011 4.25310 2.62700 0.0032 0.0032 0.0032 -2.4851
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Ag 0.04133 3.34321 -2.91379 -0.0094 -0.0094 -0.0094 -2.2768
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Ag -2.29727 3.99809 -1.50797 0.0025 0.0025 0.0025 -2.6800
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Ag 6.40664 1.07314 -0.95786 0.0028 0.0028 0.0028 -2.0016
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Ag 5.10468 -3.39813 -0.00422 -0.0026 -0.0026 -0.0026 -2.3986
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Ag 0.63639 4.54206 -0.11270 0.0014 0.0014 0.0014 -2.3827
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Ag 1.17276 -4.50732 -1.19963 0.0048 0.0048 0.0048 -2.5309
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Ag 5.25961 0.93058 3.81951 -0.0052 -0.0052 -0.0052 -2.3114
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Ag 6.10181 -0.81349 0.95868 0.0012 0.0012 0.0012 -2.2997
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Ag -1.75385 3.35322 1.20824 -0.0051 -0.0051 -0.0051 -2.6932
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Ag 5.13574 3.13989 5.01682 0.0026 0.0026 0.0026 -2.0122
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Ag 0.43575 -4.29658 2.31960 -0.0029 -0.0029 -0.0029 -2.3782
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Ag 4.29090 0.71406 -4.68481 -0.0014 -0.0014 -0.0014 -1.9867
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Ag -2.08317 1.94245 5.23254 -0.0008 -0.0008 -0.0008 -2.3445
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Ag -4.97305 -2.59559 -2.52395 0.0029 0.0029 0.0029 -2.3748
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Ag -0.27530 1.72850 2.86349 -0.0024 -0.0024 -0.0024 -2.7308
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Ag 3.78138 0.94754 -1.92736 -0.0018 -0.0018 -0.0018 -2.5021
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Ag -3.01829 3.04746 -3.98039 0.0015 0.0015 0.0015 -2.3496
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Ag -3.34693 -0.20303 -4.62889 0.0005 0.0005 0.0005 -2.4912
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Ag -0.54392 -1.33941 -1.99072 0.0006 0.0006 0.0006 -2.7764
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Ag -2.59282 -3.27879 -0.96400 -0.0042 -0.0042 -0.0042 -2.5997
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Ag -4.82611 1.25856 4.17971 -0.0041 -0.0041 -0.0041 -2.1745
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Ag 0.52197 3.18663 5.21644 -0.0043 -0.0043 -0.0043 -2.3582
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Ag 0.23784 0.37581 5.23762 0.0002 0.0002 0.0002 -2.4126
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Ag 3.54012 -0.99340 1.51482 -0.0012 -0.0012 -0.0012 -2.6197
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Ag 2.32345 -1.36520 -1.17540 -0.0046 -0.0046 -0.0046 -2.6962
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Ag -1.48975 -5.21832 -2.88276 0.0023 0.0023 0.0023 -2.5535
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Ag -0.35391 -6.68353 -5.11286 0.0005 0.0005 0.0005 -1.9708
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Ag 2.52116 1.70762 4.00619 0.0036 0.0036 0.0036 -2.5478
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Ag 6.56536 3.46992 2.88720 0.0023 0.0023 0.0023 -1.9567
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Ag 1.61853 0.34356 -5.68145 -0.0064 -0.0064 -0.0064 -2.2213
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Ag -1.76878 -4.48620 -5.56262 0.0041 0.0041 0.0041 -2.3963
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Ag -4.28785 -1.59385 0.82298 0.0049 0.0049 0.0049 -2.3454
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Ag -1.39945 -5.69727 -0.26177 0.0075 0.0075 0.0075 -2.1550
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Ag 2.92777 -4.31950 1.53841 -0.0002 -0.0002 -0.0002 -2.4694
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Ag -0.47478 -1.11957 -4.86665 -0.0031 -0.0031 -0.0031 -2.5145
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Ag 0.27601 -0.86956 2.69080 -0.0051 -0.0051 -0.0051 -2.6965
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Ag 4.81145 1.75556 0.99993 0.0035 0.0035 0.0035 -2.5637
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Ag -0.27389 2.04269 -0.62644 0.0060 0.0060 0.0060 -2.5967
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Ag -0.91826 -3.00915 4.07872 0.0015 0.0015 0.0015 -2.1087
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Ag -2.44187 -2.52817 -3.55695 0.0029 0.0029 0.0029 -2.7665
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Ag -1.49804 0.47222 1.00384 -0.0004 -0.0004 -0.0004 -2.6037
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Ag -6.86915 1.87251 1.99652 -0.0083 -0.0083 -0.0083 -2.1921
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Ag 2.86271 -1.31980 -3.80882 -0.0005 -0.0005 -0.0005 -2.4833
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Ag 1.33689 -6.42895 0.63206 -0.0013 -0.0013 -0.0013 -2.2012
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Ag -4.35200 -5.15574 -4.58790 0.0024 0.0024 0.0024 -2.1365
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Ag -1.79468 0.95956 -2.88619 0.0043 0.0043 0.0043 -2.6666
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Ag -2.52415 -0.13227 3.38703 -0.0023 -0.0023 -0.0023 -2.6037
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Ag -4.04316 4.55437 0.80786 0.0027 0.0027 0.0027 -2.3249
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Ag -2.13234 -2.68242 1.58753 -0.0075 -0.0075 -0.0075 -2.4693
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Ag -1.12950 1.30298 -5.46333 -0.0006 -0.0006 -0.0006 -2.2768
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Ag 3.38835 -0.07094 5.72579 0.0023 0.0023 0.0023 -1.9455
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Ag 0.22874 -3.58420 -4.01429 -0.0050 -0.0050 -0.0050 -2.4456
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Ag 4.01133 -5.84952 -0.21531 -0.0026 -0.0026 -0.0026 -2.1361
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Ag 1.23147 0.81694 -2.92600 -0.0007 -0.0007 -0.0007 -2.6945
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Ag -4.02545 2.01719 -1.47940 -0.0050 -0.0050 -0.0050 -2.6579
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Ag -4.90859 4.46324 -2.29337 -0.0037 -0.0037 -0.0037 -2.3078
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Ag -1.50889 6.17575 0.65386 -0.0042 -0.0042 -0.0042 -2.1652
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Ag -3.83304 1.90627 1.78905 -0.0003 -0.0003 -0.0003 -2.7028
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Ag -5.03925 -2.60990 -5.36655 -0.0038 -0.0038 -0.0038 -2.2096
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Ag 0.49748 -2.45296 0.40159 0.0003 0.0003 0.0003 -2.6425
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Ag -3.85440 6.58167 -0.84929 -0.0063 -0.0063 -0.0063 -2.0387
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Ag 4.87312 -1.82192 -2.14929 -0.0028 -0.0028 -0.0028 -2.3611
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Ag -3.26573 -0.63740 -1.44146 0.0074 0.0074 0.0074 -2.7129
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Ag -6.04578 -0.60450 2.44992 -0.0049 -0.0049 -0.0049 -2.1786
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Ag 5.12038 -2.58914 3.19888 0.0006 0.0006 0.0006 -2.0383
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