68 lines
6.5 KiB
Plaintext
68 lines
6.5 KiB
Plaintext
65
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Ag Ag pos(A), vel, pot-en(eV)
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Ag -0.38770 -26.18893 -24.81397 -0.0010 -0.0010 -0.0010 -2.7804
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Ag -0.85633 -23.58346 -25.33924 -0.0015 -0.0015 -0.0015 -2.7745
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Ag -3.11346 -25.72837 -24.15732 -0.0019 -0.0019 -0.0019 -2.8032
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Ag 2.23607 -26.91849 -25.04343 0.0002 0.0002 0.0002 -2.8323
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Ag 0.18453 -28.88705 -24.39743 -0.0006 -0.0006 -0.0006 -2.9085
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Ag -1.52981 -25.48619 -27.34612 -0.0004 -0.0004 -0.0004 -2.8147
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Ag -1.07179 -24.75425 -22.64368 -0.0007 -0.0007 -0.0007 -2.8410
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Ag -0.08080 -27.86556 -27.18994 0.0002 0.0002 0.0002 -2.9245
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Ag 0.89155 -26.85538 -22.53086 -0.0014 -0.0014 -0.0014 -2.8898
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Ag 1.20034 -24.91236 -26.77913 0.0021 0.0021 0.0021 -2.8540
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Ag 1.51298 -24.41807 -24.02852 0.0013 0.0013 0.0013 -2.8307
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Ag -2.42956 -28.14678 -25.41706 -0.0005 -0.0005 -0.0005 -2.8887
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Ag -1.97592 -27.80032 -22.82955 -0.0004 -0.0004 -0.0004 -2.8241
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Ag -3.38236 -23.22140 -25.14935 0.0000 0.0000 0.0000 -2.7303
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Ag -5.61789 -24.85096 -23.68757 0.0002 0.0002 0.0002 -2.4894
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Ag 4.68840 -27.85008 -25.46088 -0.0001 -0.0001 -0.0001 -2.3018
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Ag 0.87952 -31.47670 -23.78411 -0.0005 -0.0005 -0.0005 -2.3357
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Ag -3.20489 -25.20358 -29.52656 0.0008 0.0008 0.0008 -2.6144
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Ag -1.54636 -23.16779 -20.44175 -0.0001 -0.0001 -0.0001 -2.3372
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Ag 0.40767 -29.48133 -29.35429 0.0014 0.0014 0.0014 -2.3646
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Ag 2.52712 -27.13534 -20.10914 -0.0030 -0.0030 -0.0030 -2.2261
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Ag 2.92559 -23.43431 -28.38853 -0.0011 -0.0011 -0.0011 -2.1913
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Ag 3.41518 -22.43148 -22.93738 0.0028 0.0028 0.0028 -2.2401
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Ag -4.06210 -30.13643 -25.99272 -0.0005 -0.0005 -0.0005 -2.4591
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Ag -2.86527 -28.58430 -20.33037 0.0001 0.0001 0.0001 -2.2400
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Ag -5.91720 -22.55288 -25.22137 0.0001 0.0001 0.0001 -2.3251
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Ag -6.74077 -25.53888 -26.15511 0.0036 0.0036 0.0036 -2.3235
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Ag -5.71478 -25.87090 -28.84706 0.0011 0.0011 0.0011 -2.3830
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Ag -3.58445 -23.71730 -22.04431 0.0009 0.0009 0.0009 -2.5972
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Ag 0.39704 -25.25509 -20.26475 -0.0014 -0.0014 -0.0014 -2.5717
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Ag -0.25321 -24.40972 -29.43953 0.0007 0.0007 0.0007 -2.4744
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Ag 1.64357 -26.45994 -28.97089 -0.0026 -0.0026 -0.0026 -2.4926
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Ag -4.27197 -21.33292 -23.44999 0.0012 0.0012 0.0012 -2.2970
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Ag 0.94090 -21.75407 -24.53998 -0.0014 -0.0014 -0.0014 -2.5509
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Ag -4.90252 -23.36800 -27.79749 0.0022 0.0022 0.0022 -2.4566
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Ag -4.22927 -25.80903 -26.73415 0.0009 0.0009 0.0009 -2.6834
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Ag -2.89401 -27.62912 -28.11335 -0.0006 -0.0006 -0.0006 -2.7493
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Ag -2.37203 -25.94968 -20.54334 -0.0023 -0.0023 -0.0023 -2.5699
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Ag -0.28283 -28.16024 -20.45475 -0.0030 -0.0030 -0.0030 -2.5185
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Ag -4.49477 -26.92511 -22.02256 -0.0034 -0.0034 -0.0034 -2.4966
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Ag 2.69875 -29.82427 -24.91968 -0.0000 -0.0000 -0.0000 -2.5249
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Ag 2.60881 -28.54204 -27.40188 -0.0008 -0.0008 -0.0008 -2.5423
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Ag -1.65337 -30.95357 -24.89450 0.0023 0.0023 0.0023 -2.5751
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Ag 2.81686 -24.95250 -21.69992 0.0029 0.0029 0.0029 -2.5826
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Ag 1.72758 -29.46533 -22.14616 -0.0011 -0.0011 -0.0011 -2.5478
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Ag -2.32200 -22.92767 -27.95457 -0.0006 -0.0006 -0.0006 -2.5808
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Ag 0.43561 -22.41242 -27.48786 0.0003 0.0003 0.0003 -2.5368
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Ag -3.99023 -20.80505 -26.19574 0.0010 0.0010 0.0010 -2.2776
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Ag 0.77163 -22.90721 -21.90469 -0.0001 -0.0001 -0.0001 -2.5862
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Ag 0.73015 -30.65677 -26.63615 -0.0008 -0.0008 -0.0008 -2.5256
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Ag -1.69782 -30.04083 -27.53885 0.0011 0.0011 0.0011 -2.6577
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Ag -4.22943 -29.81699 -28.73405 -0.0001 -0.0001 -0.0001 -2.3661
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Ag -0.95033 -30.16976 -22.11550 0.0004 0.0004 0.0004 -2.5385
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Ag -1.00329 -27.00364 -29.94814 0.0028 0.0028 0.0028 -2.5485
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Ag -1.62077 -21.99347 -23.05798 -0.0021 -0.0021 -0.0021 -2.6697
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Ag 3.08597 -23.01693 -25.77332 0.0025 0.0025 0.0025 -2.5318
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Ag -4.28000 -27.64934 -30.51599 -0.0002 -0.0002 -0.0002 -2.3285
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Ag -3.73634 -29.80460 -23.39635 0.0021 0.0021 0.0021 -2.4416
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Ag -5.59737 -28.05135 -27.17835 0.0020 0.0020 0.0020 -2.5018
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Ag -2.05030 -29.33212 -30.24315 0.0009 0.0009 0.0009 -2.3156
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Ag -1.42921 -20.86854 -25.60903 0.0002 0.0002 0.0002 -2.3989
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Ag 4.18166 -25.07827 -24.24300 0.0026 0.0026 0.0026 -2.5613
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Ag 3.83282 -25.67798 -26.96478 -0.0016 -0.0016 -0.0016 -2.5316
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Ag -5.17451 -27.66807 -24.60290 -0.0012 -0.0012 -0.0012 -2.6350
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Ag 3.66666 -27.46406 -22.82440 0.0014 0.0014 0.0014 -2.5392
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