91 lines
8.8 KiB
Plaintext
91 lines
8.8 KiB
Plaintext
88
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Ag Ag pos(A), vel, pot-en(eV)
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Ag 0.20954 -4.16494 3.01395 0.0021 0.0021 0.0021 -2.5587
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Ag -3.36274 -1.21004 -1.63255 0.0003 0.0003 0.0003 -2.8807
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Ag -2.38478 -4.21860 2.12596 -0.0014 -0.0014 -0.0014 -2.5048
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Ag 4.98943 1.83641 -0.02000 0.0037 0.0037 0.0037 -2.4927
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Ag -4.56877 -2.65720 2.83982 0.0016 0.0016 0.0016 -2.3505
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Ag 3.34221 -1.40441 -4.61826 -0.0009 -0.0009 -0.0009 -2.5694
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Ag 6.19474 -3.64216 -1.37155 0.0011 0.0011 0.0011 -2.3628
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Ag -3.83586 -3.24152 -3.59402 0.0004 0.0004 0.0004 -2.3977
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Ag 1.44696 4.53131 1.41136 -0.0020 -0.0020 -0.0020 -2.5656
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Ag 3.76531 -2.23375 -1.97209 -0.0005 -0.0005 -0.0005 -2.8379
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Ag 0.61080 -0.57298 -5.47372 0.0029 0.0029 0.0029 -2.5542
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Ag -0.07737 -1.54302 2.13940 -0.0011 -0.0011 -0.0011 -2.8806
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Ag -2.54521 7.04998 2.07459 0.0004 0.0004 0.0004 -2.3461
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Ag 1.97074 -4.71026 0.84608 -0.0000 -0.0000 -0.0000 -2.6922
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Ag 1.12229 -3.19131 -4.59512 0.0019 0.0019 0.0019 -2.6519
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Ag -0.13796 7.16967 3.82409 -0.0006 -0.0006 -0.0006 -2.1889
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Ag 6.78851 -2.51325 1.18282 -0.0019 -0.0019 -0.0019 -2.2538
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Ag -1.38105 -0.16988 -3.42402 0.0038 0.0038 0.0038 -2.8688
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Ag -1.28567 -2.96553 -2.60087 -0.0009 -0.0009 -0.0009 -2.7853
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Ag 3.15494 2.37440 2.04451 -0.0003 -0.0003 -0.0003 -2.6928
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Ag 5.69120 -0.86993 -0.86455 -0.0024 -0.0024 -0.0024 -2.7038
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Ag -0.64819 0.44851 4.51550 -0.0019 -0.0019 -0.0019 -2.6931
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Ag 2.47618 1.21065 -3.97133 0.0017 0.0017 0.0017 -2.6601
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Ag -2.31340 2.65179 3.84402 0.0002 0.0002 0.0002 -2.7319
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Ag -2.40903 1.42490 -1.38596 -0.0007 -0.0007 -0.0007 -2.9122
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Ag 0.99844 4.67087 4.16562 -0.0036 -0.0036 -0.0036 -2.4792
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Ag -2.99699 3.25519 1.08075 0.0018 0.0018 0.0018 -2.8573
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Ag 4.20126 2.68235 -2.59650 -0.0016 -0.0016 -0.0016 -2.3624
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Ag 3.84396 -4.08031 -3.98011 -0.0031 -0.0031 -0.0031 -2.4405
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Ag -5.31908 -2.19330 0.16446 -0.0033 -0.0033 -0.0033 -2.5559
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Ag 1.28850 -1.08849 -2.71070 0.0006 0.0006 0.0006 -2.9322
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Ag 4.27267 -3.08291 0.72425 -0.0001 -0.0001 -0.0001 -2.7030
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Ag -1.03373 -5.48771 -1.57723 -0.0007 -0.0007 -0.0007 -2.5281
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Ag 1.03011 0.65380 0.56814 0.0008 0.0008 0.0008 -2.8195
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Ag 0.39382 2.43928 2.89669 -0.0012 -0.0012 -0.0012 -2.8682
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Ag -0.52070 -3.43333 0.26660 0.0027 0.0027 0.0027 -2.8935
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Ag -0.02827 6.88013 0.92656 -0.0010 -0.0010 -0.0010 -2.3622
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Ag -0.89790 -4.93886 -4.23373 -0.0013 -0.0013 -0.0013 -2.2969
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Ag 1.35928 -6.64169 -1.05597 0.0003 0.0003 0.0003 -2.3341
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Ag 6.06726 -2.16940 -3.54094 0.0005 0.0005 0.0005 -2.2931
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Ag -1.90626 5.41825 -0.37666 0.0002 0.0002 0.0002 -2.6687
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Ag -5.11275 1.11943 -2.40431 0.0014 0.0014 0.0014 -2.5752
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Ag -3.07686 1.98135 -4.12663 -0.0010 -0.0010 -0.0010 -2.5512
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Ag 2.61117 2.47508 4.79140 -0.0003 -0.0003 -0.0003 -2.5270
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Ag -0.99485 4.90848 2.45475 0.0006 0.0006 0.0006 -2.7418
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Ag -6.68983 0.27447 -0.28093 -0.0015 -0.0015 -0.0015 -2.3750
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Ag -0.34289 1.89311 -4.89391 -0.0000 -0.0000 -0.0000 -2.5301
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Ag -3.82281 3.76223 -1.74777 -0.0009 -0.0009 -0.0009 -2.5461
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Ag -2.62146 -1.55408 1.31240 -0.0040 -0.0040 -0.0040 -2.8491
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Ag 2.49146 -2.66329 2.74125 0.0031 0.0031 0.0031 -2.6885
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Ag -2.05574 0.33435 -6.13787 0.0039 0.0039 0.0039 -2.3369
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Ag -1.13376 3.74143 -2.63220 0.0009 0.0009 0.0009 -2.6492
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Ag 1.45746 -3.74346 -1.75743 0.0017 0.0017 0.0017 -2.8543
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Ag 0.47399 1.50004 -2.05371 0.0024 0.0024 0.0024 -2.9071
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Ag 3.88649 -0.28605 1.50916 0.0035 0.0035 0.0035 -2.8697
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Ag -1.47158 0.97697 1.67820 0.0009 0.0009 0.0009 -2.8763
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Ag 3.63208 -0.96074 5.39554 0.0010 0.0010 0.0010 -2.2969
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Ag 0.91203 5.41278 -1.03211 0.0012 0.0012 0.0012 -2.4388
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Ag 5.03831 0.24704 -3.29080 0.0034 0.0034 0.0034 -2.4611
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Ag -5.95585 -0.37839 2.31544 -0.0001 -0.0001 -0.0001 -2.3890
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Ag -4.03269 0.71320 0.67753 0.0026 0.0026 0.0026 -2.8458
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Ag 1.41461 0.35817 6.15219 -0.0015 -0.0015 -0.0015 -2.3607
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Ag -4.51223 5.41346 0.56095 0.0020 0.0020 0.0020 -2.3646
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Ag 4.90320 1.10795 4.07138 -0.0028 -0.0028 -0.0028 -2.3608
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Ag -0.48106 -6.08320 1.08924 0.0010 0.0010 0.0010 -2.3700
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Ag 1.56566 3.72033 -3.26360 0.0020 0.0020 0.0020 -2.4601
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Ag -0.38048 3.10950 0.08478 0.0003 0.0003 0.0003 -2.9212
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Ag 1.83669 -1.87781 0.09109 -0.0006 -0.0006 -0.0006 -2.8830
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Ag 3.89019 -5.01686 -1.29689 -0.0026 -0.0026 -0.0026 -2.5434
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Ag -0.04203 2.78887 5.77104 -0.0005 -0.0005 -0.0005 -2.4618
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Ag -3.25296 -3.88247 -0.80714 0.0004 0.0004 0.0004 -2.5617
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Ag -5.56113 2.95291 0.12393 -0.0006 -0.0006 -0.0006 -2.4666
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Ag 1.85009 -5.66614 -3.49925 0.0017 0.0017 0.0017 -2.3545
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Ag -5.89645 -1.40079 -2.37366 0.0021 0.0021 0.0021 -2.3451
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Ag 2.35531 3.02507 -0.64870 0.0023 0.0023 0.0023 -2.7497
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Ag 5.35251 -1.67688 3.38370 -0.0012 -0.0012 -0.0012 -2.4195
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Ag 6.45118 0.12642 1.66167 -0.0006 -0.0006 -0.0006 -2.3521
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Ag -0.70658 -0.75364 -0.64221 0.0012 0.0012 0.0012 -2.8637
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Ag 1.91832 0.08277 3.40058 -0.0022 -0.0022 -0.0022 -2.9071
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Ag -3.75649 4.94756 3.23978 -0.0011 -0.0011 -0.0011 -2.4733
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Ag -3.96387 -0.52487 -4.30680 0.0005 0.0005 0.0005 -2.5662
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Ag 0.69933 -2.09126 4.82006 -0.0018 -0.0018 -0.0018 -2.5276
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Ag 3.11687 0.40208 -1.28743 -0.0019 -0.0019 -0.0019 -2.8816
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Ag -1.95980 -2.24996 4.02206 0.0009 0.0009 0.0009 -2.5513
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Ag -1.54537 -2.22211 -5.13441 0.0008 0.0008 0.0008 -2.5422
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Ag -3.42266 0.09648 3.50189 0.0006 0.0006 0.0006 -2.6645
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Ag -4.95843 2.31415 2.72691 -0.0003 -0.0003 -0.0003 -2.5053
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Ag -1.69191 4.95321 4.96115 -0.0017 -0.0017 -0.0017 -2.3667
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