lammps-graphene/docs/midterm_pres/output/pres_multi_relaxed.xyz

ITEM: TIMESTEP
0
ITEM: NUMBER OF ATOMS
872
ITEM: BOX BOUNDS mm mm mm
-30 30
-25 25
-1 1
ITEM: ATOMS id element x y z fx fy fz 
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2 C -3.58869 18.113 0 -4.11265 1.95953 0 
3 C -5.11814 14.1345 0 5318.31 1978.96 0 
4 C -3.71364 14.357 0 1.65354 0.266111 0 
5 C -3.20383 15.6831 0 -0.13239 0.695254 0 
6 C -1.79933 15.9056 0 -150.805 -12.4135 0 
7 C -5.2431 10.3784 0 -3.57822 -2.15202 0 
8 C -4.73328 11.7046 0 -2.95257 1.86119 0 
9 C -3.32879 11.9271 0 -0.382158 0.292795 0 
10 C -2.81897 13.2532 0 -0.580182 -0.718401 0 
11 C -1.41448 13.4757 0 -2.82442 3.07907 0 
12 C -0.904659 14.8019 0 -191.474 -56.2233 0 
13 C -6.77255 6.39991 0 -2.65503 -2.41003 0 
14 C -6.26273 7.72608 0 -2.5082 -1.0501 0 
15 C -4.85824 7.94853 0 -0.337769 0.212487 0 
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17 C -2.94393 9.49716 0 -0.0377659 -0.00718055 0 
18 C -2.43411 10.8233 0 0.0366546 0.0094645 0 
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20 C -0.519801 12.372 0 3.41381 0.250938 0 
21 C -7.79218 3.74756 0 1.71203 -8.48262 0 
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61 C -0.894676 1.10373 0 0.0377529 0.00566163 0 
62 C 0.509817 1.32618 0 0.526693 -0.0922554 0 
63 C 1.01963 2.65235 0 -0.120417 -0.219552 0 
64 C 2.42413 2.8748 0 2.20088 -4.47788 0 
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71 C -2.42413 -2.8748 0 -1.75795 3.7337 0 
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82 C -23.191 19.9221 0 0.79466 1.99677 0 
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107 C -17.6728 16.464 0 0.453244 0.0154758 0 
108 C -17.3525 17.8482 0 10.6493 2.16334 0 
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650 C 5.4462 -13.3491 0 -0.0397562 -0.00205761 0 
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655 C 10.2914 -9.48738 0 0.0365478 0.0022617 0 
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657 C 12.3801 -8.18359 0 0.0412443 0.00162725 0 
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661 C 16.5577 -5.57602 0 0.0372769 0.00192125 0 
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663 C 18.6465 -4.27223 0 0.0358213 0.00021724 0 
664 C 20.0676 -4.22261 0 -0.0371616 -0.00198768 0 
665 C 20.7352 -2.96845 0 0.0406041 0.00200647 0 
666 C 22.1564 -2.91882 0 1.656 0.0575601 0 
667 C 22.824 -1.66466 0 -1.66164 -0.0572734 0 
668 C 2.02215 -17.1612 0 -18.4415 27.2561 0 
669 C 3.44328 -17.1116 0 12.8589 11.5845 0 
670 C 4.11092 -15.8574 0 -0.0119036 -2.03126 0 
671 C 5.53205 -15.8078 0 -0.0391297 -0.00167024 0 
672 C 6.19969 -14.5536 0 0.0381025 -0.00138625 0 
673 C 7.62083 -14.504 0 -0.0383181 -0.00486901 0 
674 C 8.28846 -13.2499 0 0.0386159 0.00533066 0 
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684 C 18.7323 -6.73093 0 0.0409657 0.00262421 0 
685 C 20.1535 -6.6813 0 -0.0424939 -0.000279621 0 
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688 C 22.9099 -4.12335 0 -1.66274 -0.0590806 0 
689 C 5.61791 -18.2665 0 6.29964 9.84654 0 
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691 C 7.70668 -16.9627 0 2.95595 3.06459 0 
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701 C 18.1505 -10.4438 0 -0.0359348 0.00134524 0 
702 C 18.8182 -9.18962 0 0.035411 1.22832e-05 0 
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705 C 22.3281 -7.8362 0 1.65629 0.0570219 0 
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707 C 8.46018 -18.1672 0 18.7481 27.343 0 
708 C 9.88132 -18.1176 0 3.71417 3.57137 0 
709 C 10.549 -16.8635 0 0.0569059 -0.0523307 0 
710 C 11.9701 -16.8138 0 -0.0391077 -0.0104269 0 
711 C 12.6377 -15.5597 0 0.0410741 0.00576664 0 
712 C 14.0589 -15.51 0 -0.0411569 -0.00606579 0 
713 C 14.7265 -14.2559 0 0.038493 0.00287345 0 
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745 C 18.494 -20.2785 0 -6.04219 8.41708 0 
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750 C 23.3392 -16.4168 0 -1.66281 -0.0612802 0 
751 C 20.6686 -21.4335 0 -10.08 24.0652 0 
752 C 21.3362 -20.1793 0 -3.24744 2.87984 0 
753 C 22.7574 -20.1297 0 -3.26689 17.4965 0 
754 C 23.425 -18.8755 0 -1.6591 -0.85968 0 
755 C -17.7894 23.0937 0 29.2557 10.8001 0 
756 C -16.3891 23.3407 0 -2.88895 -1.53176 0 
757 C -15.9618 20.9179 0 -2.88989 -1.50612 0 
758 C -15.4753 22.2527 0 0.354901 0.487601 0 
759 C -14.0749 22.4997 0 -1.16334 0.161897 0 
760 C -13.5883 23.8345 0 2.18367 0.0692344 0 
761 C -12.1879 24.0815 0 -2.0732 -0.685549 0 
762 C -15.5346 18.495 0 816.105 436.663 0 
763 C -15.048 19.8299 0 0.599902 -13.25 0 
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765 C -13.1611 21.4117 0 0.0375641 0.00793281 0 
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767 C -11.2741 22.9935 0 1.03656 0.554241 0 
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769 C -9.38707 24.5753 0 -0.875852 -0.942531 0 
770 C -14.6208 17.4071 0 -2.52577 -4.62073 0 
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774 C -10.8469 20.5707 0 0.0404181 0.00573222 0 
775 C -9.44646 20.8176 0 -0.0391033 -0.00449742 0 
776 C -8.95986 22.1525 0 0.0637063 0.0757986 0 
777 C -7.55946 22.3994 0 -1.10033 0.242775 0 
778 C -7.07287 23.7343 0 3.07679 -0.08909 0 
779 C -5.67247 23.9812 0 1.08044 13.2345 0 
780 C -14.1936 14.9843 0 -0.693205 -3.97974 0 
781 C -12.7932 15.2312 0 -0.196197 0.818197 0 
782 C -12.3066 16.5661 0 0.0380138 0.00431011 0 
783 C -10.9062 16.813 0 -0.038789 -0.003772 0 
784 C -10.4196 18.1479 0 0.0359729 0.00424741 0 
785 C -9.01925 18.3948 0 -0.0359874 -0.00413598 0 
786 C -8.53265 19.7297 0 0.0373356 0.00442158 0 
787 C -7.13226 19.9766 0 -0.0374419 -0.00456993 0 
788 C -6.64566 21.3115 0 0.651565 0.112424 0 
789 C -5.24527 21.5584 0 -0.305865 -1.61617 0 
790 C -4.75867 22.8933 0 3.00863 -20.316 0 
791 C -12.366 12.8084 0 22.2806 5.81382 0 
792 C -11.8794 14.1433 0 0.43986 -0.193013 0 
793 C -10.479 14.3902 0 -0.0391417 -0.00483192 0 
794 C -9.99244 15.7251 0 0.0391293 0.00410315 0 
795 C -8.59204 15.972 0 -0.0380477 -0.00434568 0 
796 C -8.10545 17.3069 0 0.0380947 0.00450046 0 
797 C -6.70505 17.5538 0 0.163483 0.21843 0 
798 C -6.21845 18.8887 0 0.435048 -0.382843 0 
799 C -4.81806 19.1356 0 5.29632 -0.993255 0 
800 C -4.33146 20.4705 0 1.78529 2.38635 0 
801 C -11.9388 10.3856 0 132.699 28.5587 0 
802 C -11.4522 11.7205 0 1.77724 -0.536036 0 
803 C -10.0518 11.9674 0 -0.0547874 -0.0369289 0 
804 C -9.56523 13.3023 0 0.038971 0.00409787 0 
805 C -8.16483 13.5492 0 -0.0366344 -0.00690875 0 
806 C -7.67824 14.8841 0 0.00868837 -1.12837 0 
807 C -6.27784 15.131 0 -0.776056 1.15262 0 
808 C -5.79125 16.4659 0 6.19263 0.912834 0 
809 C -11.025 9.29764 0 -0.966505 -0.964756 0 
810 C -9.62462 9.54457 0 -1.08931 -0.788861 0 
811 C -9.13802 10.8794 0 0.037752 0.00975035 0 
812 C -7.73763 11.1264 0 -0.0102446 0.134406 0 
813 C -7.25103 12.4612 0 -0.0352928 0.765642 0 
814 C -5.85063 12.7082 0 2.30137 -2.01968 0 
815 C -5.36404 14.043 0 -5318.31 -1978.95 0 
816 C -10.5978 6.87482 0 3.68443 -0.853049 0 
817 C -9.19741 7.12175 0 -1.7666 0.0341022 0 
818 C -8.71081 8.45662 0 0.308284 -0.188258 0 
819 C -7.31042 8.70355 0 2.38123 1.09231 0 
820 C -6.82382 10.0384 0 3.58663 1.93884 0 
821 C -8.7702 4.69894 0 -2.66491 0.897004 0 
822 C -8.28361 6.03381 0 1.48813 1.8601 0 
823 C -8.34299 2.27612 0 -6.80696 69.5753 0 
824 C -19.4159 -20.9106 0 -5.01618 2.45463 0 
825 C -18.9293 -19.5757 0 -0.72953 6.65201 0 
826 C -17.5289 -19.3288 0 1.22345 3.92232 0 
827 C -17.0423 -17.9939 0 4.97855 -4.99913 0 
828 C -15.6419 -17.747 0 1.25285 4.52347 0 
829 C -15.1553 -16.4121 0 -1.96582 -5.71733 0 
830 C -13.7549 -16.1652 0 4.66063 1.88547 0 
831 C -18.9887 -23.3334 0 -2.12668 2.04206 0 
832 C -18.5021 -21.9985 0 1.28738 1.41151 0 
833 C -17.1017 -21.7516 0 -0.0380457 -0.00432697 0 
834 C -16.6151 -20.4167 0 0.0369907 0.0054005 0 
835 C -15.2147 -20.1698 0 -0.0378602 -0.00446554 0 
836 C -14.7281 -18.8349 0 0.0327255 0.00909412 0 
837 C -13.3277 -18.588 0 -0.0378719 -0.00454031 0 
838 C -12.8411 -17.2531 0 -0.287904 1.12311 0 
839 C -11.4407 -17.0062 0 -0.536723 0.3823 0 
840 C -10.9541 -15.6713 0 -4.94923 -2.52966 0 
841 C -9.55373 -15.4244 0 0.73077 -121.656 0 
842 C -18.0749 -24.4213 0 1.23896 0.802084 0 
843 C -16.6745 -24.1744 0 -2.18196 -0.0654906 0 
844 C -16.1879 -22.8395 0 1.16349 -0.168376 0 
845 C -14.7875 -22.5926 0 -1.03647 -0.551847 0 
846 C -14.3009 -21.2577 0 0.0379116 0.0045915 0 
847 C -12.9005 -21.0108 0 -0.0378915 -0.00451085 0 
848 C -12.4139 -19.6759 0 0.0378705 0.00442542 0 
849 C -11.0135 -19.429 0 -0.037922 -0.00435172 0 
850 C -10.5269 -18.0941 0 0.0372482 0.00409104 0 
851 C -9.12652 -17.8472 0 -0.0402128 -0.000109823 0 
852 C -8.63993 -16.5123 0 -0.480745 1.03171 0 
853 C -7.23953 -16.2654 0 2.31664 0.311545 0 
854 C -13.8737 -23.6805 0 0.613573 1.55283 0 
855 C -12.4733 -23.4336 0 -0.621552 -1.60626 0 
856 C -11.9867 -22.0987 0 0.0380978 0.00482912 0 
857 C -10.5863 -21.8518 0 -0.038096 -0.00428031 0 
858 C -10.0997 -20.5169 0 0.0374987 0.00426707 0 
859 C -8.69931 -20.27 0 -0.0375294 -0.00452934 0 
860 C -8.21272 -18.9351 0 0.049812 0.0261213 0 
861 C -6.81232 -18.6882 0 -0.961676 -2.62334 0 
862 C -6.32573 -17.3533 0 -23.0858 9.93327 0 
863 C -11.5595 -24.5215 0 2.07452 0.682622 0 
864 C -10.1591 -24.2746 0 -2.18206 -0.0654735 0 
865 C -9.6725 -22.9397 0 1.16304 -0.168487 0 
866 C -8.27211 -22.6928 0 -1.03437 -0.554111 0 
867 C -7.78551 -21.3579 0 0.0377664 0.00436109 0 
868 C -6.38511 -21.111 0 0.10607 -0.922013 0 
869 C -5.89852 -19.7761 0 0.816464 -1.55164 0 
870 C -7.3583 -23.7808 0 2.07272 0.685737 0 
871 C -5.95791 -23.5338 0 -3.05312 -0.94795 0 
872 C -5.47131 -22.199 0 3.12921 -1.33482 0 
ITEM: TIMESTEP
498
ITEM: NUMBER OF ATOMS
872
ITEM: BOX BOUNDS mm mm mm
-30 30
-25 25
-1 1
ITEM: ATOMS id element x y z fx fy fz 
1 C -4.55342 16.7654 0 -8.87214e-05 -0.000637326 0 
2 C -4.00673 18.1305 0 0.00025837 0.00025115 0 
3 C -4.77324 14.0873 0 0.00010122 -0.000338169 0 
4 C -3.53597 14.4232 0 0.00104664 -0.00185513 0 
5 C -3.52507 15.7969 0 0.000124603 0.00217732 0 
6 C -2.30213 16.2869 0 0.000141974 -0.00101516 0 
7 C -5.59365 10.2799 0 -1.7637e-05 -3.18294e-05 0 
8 C -5.15061 11.6837 0 -6.30095e-05 -2.39161e-05 0 
9 C -3.62349 11.9592 0 0.000162716 1.30689e-05 0 
10 C -2.81326 13.2408 0 -0.00209074 0.000947361 0 
11 C -1.43487 13.4179 0 0.00166123 0.000667122 0 
12 C -0.751496 14.6586 0 -0.000288298 -0.000903029 0 
13 C -7.06666 6.23497 0 -2.40066e-05 -1.4864e-05 0 
14 C -6.56939 7.58868 0 -2.46169e-06 -4.86616e-06 0 
15 C -5.12231 7.82746 0 -2.98953e-05 1.01925e-05 0 
16 C -4.64177 9.18555 0 -3.45197e-05 1.7275e-05 0 
17 C -3.20941 9.40591 0 1.59603e-05 9.97393e-05 0 
18 C -2.75766 10.7773 0 -0.000218671 -0.000144724 0 
19 C -1.33952 10.989 0 0.000188348 8.03657e-05 0 
20 C -0.655156 12.2439 0 -0.000252517 0.00010711 0 
21 C -7.86228 3.60143 0 -3.33129e-05 -5.46608e-06 0 
22 C -6.46367 3.86131 0 -3.32377e-05 2.01868e-05 0 
23 C -6.03102 5.20737 0 -2.03373e-05 4.91988e-06 0 
24 C -4.59498 5.42733 0 -6.23967e-06 1.01434e-05 0 
25 C -4.12089 6.7686 0 5.43443e-07 1.02083e-05 0 
26 C -2.67832 6.96322 0 -2.40751e-05 2.56321e-05 0 
27 C -2.22833 8.3027 0 -5.65161e-05 4.08521e-06 0 
28 C -0.798407 8.50845 0 1.36205e-05 6.27985e-05 0 
29 C -0.500954 9.87119 0 -0.000135495 -9.70675e-05 0 
30 C 0.80577 10.1654 0 -6.95267e-05 -6.6558e-06 0 
31 C -8.21903 -0.253697 0 -1.58495e-05 7.77505e-06 0 
32 C -7.30335 1.15879 0 -2.01155e-05 1.98853e-05 0 
33 C -5.95842 1.43661 0 -5.88341e-05 1.99247e-05 0 
34 C -5.50291 2.78904 0 -2.23338e-05 3.30626e-05 0 
35 C -4.08953 3.02837 0 -2.02265e-05 3.1809e-05 0 
36 C -3.59954 4.37123 0 -8.86643e-06 2.51036e-05 0 
37 C -2.15274 4.57875 0 6.37301e-06 2.90737e-05 0 
38 C -1.64268 5.92567 0 -5.44308e-06 9.82239e-06 0 
39 C -0.154731 6.12482 0 2.07826e-05 2.32436e-05 0 
40 C 0.365044 7.51184 0 -1.25073e-06 1.88424e-05 0 
41 C 1.96216 7.65976 0 2.11283e-05 3.13956e-05 0 
42 C -7.55525 -2.6301 0 -2.98621e-05 6.2535e-06 0 
43 C -7.1121 -1.29575 0 -3.98425e-05 1.18818e-05 0 
44 C -5.71253 -0.972567 0 -5.10345e-05 2.27103e-05 0 
45 C -5.10576 0.331073 0 -3.35393e-05 2.00482e-05 0 
46 C -3.7077 0.594443 0 -4.66577e-05 2.95547e-05 0 
47 C -3.17622 1.92655 0 -1.12587e-05 4.16466e-05 0 
48 C -1.75458 2.15356 0 -2.09703e-05 2.79102e-05 0 
49 C -1.21275 3.48321 0 -1.53169e-06 1.97101e-05 0 
50 C 0.232643 3.66655 0 -2.38842e-07 2.02936e-05 0 
51 C 0.794523 5.00271 0 1.76608e-05 2.75028e-05 0 
52 C 2.26385 5.12651 0 2.59364e-05 2.55456e-05 0 
53 C 2.8586 6.44995 0 3.92154e-05 2.35931e-05 0 
54 C -7.28807 -4.93283 0 -2.79892e-05 -6.73883e-06 0 
55 C -6.63044 -3.65713 0 -2.76878e-05 2.88313e-06 0 
56 C -5.2739 -3.38819 0 -3.88147e-05 -9.88183e-06 0 
57 C -4.79655 -2.05941 0 -4.78947e-05 2.64093e-05 0 
58 C -3.39905 -1.82078 0 -6.32526e-05 1.51731e-05 0 
59 C -2.83084 -0.512586 0 -5.01692e-05 2.32337e-05 0 
60 C -1.42768 -0.27799 0 -5.93174e-05 3.70348e-05 0 
61 C -0.865806 1.03441 0 -3.37141e-05 2.96749e-05 0 
62 C 0.559883 1.20898 0 -3.37172e-05 9.47964e-06 0 
63 C 1.13205 2.52747 0 -1.45554e-05 6.5502e-06 0 
64 C 2.57864 2.64817 0 -8.83561e-06 1.38839e-05 0 
65 C 3.17476 3.96674 0 4.41308e-06 2.37407e-05 0 
66 C -6.85254 -7.26367 0 1.81857e-06 -4.45511e-05 0 
67 C -6.35246 -5.98519 0 -6.65397e-05 2.84499e-05 0 
68 C -4.95226 -5.79819 0 -3.61562e-05 -4.75874e-05 0 
69 C -4.43036 -4.49393 0 -2.36958e-05 4.33878e-05 0 
70 C -3.06163 -4.27919 0 -6.93615e-05 1.9468e-05 0 
71 C -2.54134 -2.94457 0 -4.8225e-05 3.22649e-05 0 
72 C -1.15034 -2.69547 0 -5.86133e-05 1.60279e-05 0 
73 C -0.572195 -1.40293 0 -5.17186e-05 3.38482e-05 0 
74 C 0.838975 -1.24438 0 -4.86636e-05 2.03067e-05 0 
75 C 1.41676 0.0582907 0 -4.35103e-05 1.25573e-05 0 
76 C -6.95665 -9.70086 0 -1.84449e-06 2.32842e-05 0 
77 C -6.10507 -8.44585 0 -0.000127472 4.3132e-05 0 
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