79 lines
7.6 KiB
Plaintext
79 lines
7.6 KiB
Plaintext
76
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Ag Ag pos(A), vel, pot-en(eV)
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Ag 2.71044 -7.18335 -1.11179 -0.0039 -0.0039 -0.0039 -1.9419
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Ag 3.20914 0.78838 -2.76211 0.0033 0.0033 0.0033 -2.4930
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Ag 7.40868 0.05746 2.79016 0.0073 0.0073 0.0073 -2.0327
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Ag -3.63948 -2.83889 -0.76431 0.0050 0.0050 0.0050 -2.5446
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Ag 3.79713 2.93975 -4.27871 -0.0029 -0.0029 -0.0029 -1.9336
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Ag 0.38563 -6.35342 0.04537 0.0012 0.0012 0.0012 -2.2475
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Ag -1.20768 -5.41024 -4.83643 0.0025 0.0025 0.0025 -1.8010
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Ag 4.63803 -5.09779 -0.02599 -0.0047 -0.0047 -0.0047 -2.1273
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Ag -1.63055 -0.97499 4.35098 0.0015 0.0015 0.0015 -2.2928
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Ag -2.76803 6.89587 -0.77494 0.0045 0.0045 0.0045 -1.9030
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Ag 5.03583 0.52507 -4.54692 -0.0062 -0.0062 -0.0062 -1.9277
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Ag 2.43433 -3.46922 0.23799 -0.0029 -0.0029 -0.0029 -2.6304
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Ag 6.94518 0.98271 5.17524 -0.0048 -0.0048 -0.0048 -1.7878
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Ag -4.22304 -0.77298 -2.47443 0.0020 0.0020 0.0020 -2.5104
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Ag 1.15188 4.90539 1.79519 -0.0042 -0.0042 -0.0042 -2.3359
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Ag 2.32856 3.51685 -2.20182 -0.0013 -0.0013 -0.0013 -2.1382
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Ag 0.02719 1.61226 1.17230 -0.0011 -0.0011 -0.0011 -2.7960
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Ag -2.37965 -3.60932 1.48552 -0.0001 -0.0001 -0.0001 -2.3480
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Ag 2.33945 -1.29829 -1.34369 -0.0067 -0.0067 -0.0067 -2.4786
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Ag 1.77838 -1.28679 -5.41401 0.0057 0.0057 0.0057 -2.1922
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Ag -3.66184 -5.53079 -1.13391 0.0033 0.0033 0.0033 -2.0838
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Ag -2.71583 1.23266 -0.45406 0.0086 0.0086 0.0086 -2.7967
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Ag 1.17539 -2.79490 -2.84662 -0.0046 -0.0046 -0.0046 -2.4671
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Ag -0.07229 3.65374 -0.80819 0.0026 0.0026 0.0026 -2.5236
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Ag -0.29228 3.61793 3.64235 -0.0026 -0.0026 -0.0026 -2.5674
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Ag -2.44033 -0.00965 -4.47964 0.0044 0.0044 0.0044 -2.5640
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Ag 0.54938 0.41258 -4.03641 -0.0027 -0.0027 -0.0027 -2.6267
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Ag 1.73027 -1.13781 5.17273 0.0042 0.0042 0.0042 -2.2420
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Ag 3.52591 3.72595 1.91339 0.0044 0.0044 0.0044 -2.2586
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Ag -4.20235 2.16463 -2.63922 -0.0005 -0.0005 -0.0005 -2.5942
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Ag -5.07391 -0.83983 2.86511 -0.0022 -0.0022 -0.0022 -2.1942
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Ag 4.25487 -1.73152 0.80087 0.0059 0.0059 0.0059 -2.4662
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Ag 5.66493 0.71714 -0.21449 0.0056 0.0056 0.0056 -2.1204
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Ag -0.74908 -0.44600 -6.73288 0.0069 0.0069 0.0069 -2.0958
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Ag -2.82444 4.14741 -4.03650 0.0060 0.0060 0.0060 -2.0692
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Ag -0.76701 -2.03163 -4.43465 -0.0012 -0.0012 -0.0012 -2.5030
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Ag -2.71511 4.41711 4.08048 -0.0064 -0.0064 -0.0064 -2.3024
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Ag -5.06813 -0.51433 0.19125 -0.0018 -0.0018 -0.0018 -2.5811
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Ag 3.45071 -0.25615 3.19323 0.0000 0.0000 0.0000 -2.6872
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Ag -3.59819 2.18430 -5.37656 -0.0093 -0.0093 -0.0093 -2.0411
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Ag -2.14072 -0.68721 1.41412 -0.0014 -0.0014 -0.0014 -2.6837
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Ag -3.47254 5.82556 1.56969 0.0010 0.0010 0.0010 -2.2222
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Ag 0.10476 1.30905 5.28314 0.0021 0.0021 0.0021 -2.4319
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Ag -1.50140 2.15134 -2.72655 -0.0006 -0.0006 -0.0006 -2.7513
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Ag -0.92025 2.19254 -5.47382 0.0030 0.0030 0.0030 -2.3159
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Ag 1.39831 -5.26351 -2.17336 0.0046 0.0046 0.0046 -2.4026
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Ag 3.05550 1.36397 0.78990 -0.0015 -0.0015 -0.0015 -2.6666
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Ag -6.94326 1.69722 1.76695 0.0003 0.0003 0.0003 -1.9219
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Ag 3.20505 -5.26019 2.18184 0.0051 0.0051 0.0051 -2.1178
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Ag 0.45446 -0.63098 2.86257 0.0023 0.0023 0.0023 -2.5751
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Ag 5.86318 -1.87833 3.70656 -0.0014 -0.0014 -0.0014 -2.0771
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Ag -1.93198 3.60638 1.20301 0.0058 0.0058 0.0058 -2.5908
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Ag -6.41634 0.67671 -1.71379 -0.0045 -0.0045 -0.0045 -1.9001
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Ag -2.55808 -3.83992 -3.06918 0.0041 0.0041 0.0041 -2.4668
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Ag -0.64074 -3.85703 -0.74440 0.0055 0.0055 0.0055 -2.7976
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Ag 1.90432 2.09241 3.29446 0.0051 0.0051 0.0051 -2.5646
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Ag -2.13104 1.44949 2.81848 -0.0030 -0.0030 -0.0030 -2.5895
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Ag -1.42329 3.30497 6.07788 -0.0030 -0.0030 -0.0030 -2.0800
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Ag -1.13288 6.20504 2.95493 0.0002 0.0002 0.0002 -2.2734
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Ag -5.35537 2.15282 -0.24409 -0.0019 -0.0019 -0.0019 -2.0541
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Ag -3.24177 0.99901 5.14792 -0.0020 -0.0020 -0.0020 -2.1990
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Ag -4.66348 1.86263 3.22932 -0.0018 -0.0018 -0.0018 -2.2495
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Ag 0.40282 -3.78319 2.18538 -0.0023 -0.0023 -0.0023 -2.3983
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Ag 0.98220 1.22987 -1.32469 -0.0005 -0.0005 -0.0005 -2.6719
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Ag -1.34302 -6.22091 -2.22335 0.0007 0.0007 0.0007 -2.3572
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Ag 2.66150 -2.77565 2.84925 0.0027 0.0027 0.0027 -2.4465
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Ag -1.32253 -0.98041 -1.76180 0.0017 0.0017 0.0017 -2.7914
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Ag -0.11349 6.89299 0.71380 -0.0051 -0.0051 -0.0051 -1.9813
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Ag 0.47726 -1.36648 0.51286 0.0050 0.0050 0.0050 -2.6244
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Ag 5.80065 3.69196 0.56045 -0.0012 -0.0012 -0.0012 -1.8756
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Ag -2.86423 4.32983 -0.99824 0.0008 0.0008 0.0008 -2.4024
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Ag -5.15606 -3.39969 1.33850 0.0006 0.0006 0.0006 -2.0327
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Ag 5.33807 1.61515 2.26050 -0.0017 -0.0017 -0.0017 -2.4658
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Ag 3.65988 -1.81806 -3.82790 0.0013 0.0013 0.0013 -2.3169
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Ag 3.94177 -3.71462 -2.05574 -0.0030 -0.0030 -0.0030 -2.3315
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Ag 4.73376 -0.85899 5.65463 -0.0034 -0.0034 -0.0034 -2.0031
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