mirror of
https://asciireactor.com/otho/lammps-graphene.git
synced 2024-11-22 22:25:06 +00:00
161 lines
11 KiB
Plaintext
161 lines
11 KiB
Plaintext
|
C [atomic names] misorientational angle= 24.3153237770887
|
||
|
10.000000000000000
|
||
|
2.2902000000 0.0000000000 0.0000000000
|
||
|
0.0000000000 1.7479656057 0.0000000000
|
||
|
0.0000000000 0.0000000000 1.2000000000
|
||
|
152
|
||
|
Selective Dynamics
|
||
|
Cartestian
|
||
|
-0.0722561347 0.1070183066 0.0000000000 T T F
|
||
|
-0.3194043175 0.1426910741 0.0000000000 T T F
|
||
|
-0.1855323858 0.1962002211 0.0000000000 T T F
|
||
|
-0.1649367033 0.3388912952 0.0000000000 T T F
|
||
|
-0.0310647715 0.3924004421 0.0000000000 T T F
|
||
|
-0.0104690890 0.5350915162 0.0000000000 T T F
|
||
|
-0.5871481828 0.0356727675 0.0000000000 T T F
|
||
|
-0.5665525003 0.1783638416 0.0000000000 T T F
|
||
|
-0.4326805685 0.2318729885 0.0000000000 T T F
|
||
|
-0.4120848860 0.3745640626 0.0000000000 T T F
|
||
|
-0.2782129543 0.4280732096 0.0000000000 T T F
|
||
|
-0.2576172718 0.5707642837 0.0000000000 T T F
|
||
|
-0.1237453401 0.6242734306 0.0000000000 T T F
|
||
|
-0.1031496576 0.7669645047 0.0000000000 T T F
|
||
|
-0.9681682973 0.0178363880 0.0000000000 T T F
|
||
|
-0.8342963656 0.0713455349 0.0000000000 T T F
|
||
|
-0.8137006830 0.2140366090 0.0000000000 T T F
|
||
|
-0.6798287513 0.2675457560 0.0000000000 T T F
|
||
|
-0.6592330688 0.4102368301 0.0000000000 T T F
|
||
|
-0.5253611371 0.4637459770 0.0000000000 T T F
|
||
|
-0.5047654546 0.6064370511 0.0000000000 T T F
|
||
|
-0.3708935228 0.6599461981 0.0000000000 T T F
|
||
|
-0.3502978403 0.8026372722 0.0000000000 T T F
|
||
|
-0.2164259086 0.8561464191 0.0000000000 T T F
|
||
|
-0.1958302261 0.9988374932 0.0000000000 T T F
|
||
|
-0.0619582944 1.0523466402 0.0000000000 T T F
|
||
|
-0.0413626119 1.1950377143 0.0000000000 T T F
|
||
|
-0.9269769341 0.3032185234 0.0000000000 T T F
|
||
|
-0.9063812516 0.4459095976 0.0000000000 T T F
|
||
|
-0.7725093199 0.4994187445 0.0000000000 T T F
|
||
|
-0.7519136373 0.6421098186 0.0000000000 T T F
|
||
|
-0.6180417056 0.6956189655 0.0000000000 T T F
|
||
|
-0.5974460231 0.8383100397 0.0000000000 T T F
|
||
|
-0.4635740914 0.8918191866 0.0000000000 T T F
|
||
|
-0.4429784089 1.0345102607 0.0000000000 T T F
|
||
|
-0.3091064772 1.0880194077 0.0000000000 T T F
|
||
|
-0.2885107946 1.2307104818 0.0000000000 T T F
|
||
|
-0.1546388629 1.2842196287 0.0000000000 T T F
|
||
|
-0.1340431804 1.4269107028 0.0000000000 T T F
|
||
|
-1.0196575026 0.5350915120 0.0000000000 T T F
|
||
|
-0.9990618201 0.6777825861 0.0000000000 T T F
|
||
|
-0.8651898884 0.7312917330 0.0000000000 T T F
|
||
|
-0.8445942059 0.8739828071 0.0000000000 T T F
|
||
|
-0.7107222742 0.9274919541 0.0000000000 T T F
|
||
|
-0.6901265917 1.0701830282 0.0000000000 T T F
|
||
|
-0.5562546599 1.1236921751 0.0000000000 T T F
|
||
|
-0.5356589774 1.2663832492 0.0000000000 T T F
|
||
|
-0.4017870457 1.3198923962 0.0000000000 T T F
|
||
|
-0.3811913632 1.4625834703 0.0000000000 T T F
|
||
|
-0.2473194315 1.5160926172 0.0000000000 T T F
|
||
|
-0.2267237489 1.6587836913 0.0000000000 T T F
|
||
|
-0.0928518172 1.7122928383 0.0000000000 T T F
|
||
|
-0.9578704569 0.9631647215 0.0000000000 T T F
|
||
|
-0.9372747744 1.1058557956 0.0000000000 T T F
|
||
|
-0.8034028427 1.1593649426 0.0000000000 T T F
|
||
|
-0.7828071602 1.3020560167 0.0000000000 T T F
|
||
|
-0.6489352285 1.3555651636 0.0000000000 T T F
|
||
|
-0.6283395460 1.4982562377 0.0000000000 T T F
|
||
|
-0.4944676142 1.5517653847 0.0000000000 T T F
|
||
|
-0.4738719317 1.6944564588 0.0000000000 T T F
|
||
|
-0.3400000000 1.7479656057 0.0000000000 T T F
|
||
|
-1.0505510255 1.1950377100 0.0000000000 T T F
|
||
|
-1.0299553430 1.3377287842 0.0000000000 T T F
|
||
|
-0.8960834112 1.3912379311 0.0000000000 T T F
|
||
|
-0.8754877287 1.5339290052 0.0000000000 T T F
|
||
|
-0.7416157970 1.5874381521 0.0000000000 T T F
|
||
|
-0.7210201145 1.7301292263 0.0000000000 T T F
|
||
|
-0.9887639798 1.6231109196 0.0000000000 T T F
|
||
|
0.0711850599 0.1344588968 0.0000000000 T T F
|
||
|
0.4787419190 0.0336147272 0.0000000000 T T F
|
||
|
0.3428896338 0.0672294464 0.0000000000 T T F
|
||
|
0.3040746937 0.2016883431 0.0000000000 T T F
|
||
|
0.1682224084 0.2353030623 0.0000000000 T T F
|
||
|
0.1294074683 0.3697619591 0.0000000000 T T F
|
||
|
0.7116315528 0.1008441736 0.0000000000 T T F
|
||
|
0.5757792675 0.1344588927 0.0000000000 T T F
|
||
|
0.5369643274 0.2689177895 0.0000000000 T T F
|
||
|
0.4011120422 0.3025325087 0.0000000000 T T F
|
||
|
0.3622971021 0.4369914054 0.0000000000 T T F
|
||
|
0.2264448169 0.4706061246 0.0000000000 T T F
|
||
|
0.1876298768 0.6050650214 0.0000000000 T T F
|
||
|
0.0517775916 0.6386797406 0.0000000000 T T F
|
||
|
0.0129626514 0.7731386373 0.0000000000 T T F
|
||
|
1.1191884118 0.0000000040 0.0000000000 T T F
|
||
|
0.9833361266 0.0336147232 0.0000000000 T T F
|
||
|
0.9445211865 0.1680736199 0.0000000000 T T F
|
||
|
0.8086689013 0.2016883391 0.0000000000 T T F
|
||
|
0.7698539612 0.3361472359 0.0000000000 T T F
|
||
|
0.6340016760 0.3697619551 0.0000000000 T T F
|
||
|
0.5951867359 0.5042208518 0.0000000000 T T F
|
||
|
0.4593344507 0.5378355710 0.0000000000 T T F
|
||
|
0.4205195105 0.6722944678 0.0000000000 T T F
|
||
|
0.2846672253 0.7059091869 0.0000000000 T T F
|
||
|
0.2458522852 0.8403680837 0.0000000000 T T F
|
||
|
0.1100000000 0.8739828029 0.0000000000 T T F
|
||
|
0.0711850599 1.0084416996 0.0000000000 T T F
|
||
|
1.2162257604 0.1008441696 0.0000000000 T T F
|
||
|
1.1774108203 0.2353030663 0.0000000000 T T F
|
||
|
1.0415585351 0.2689177855 0.0000000000 T T F
|
||
|
1.0027435950 0.4033766823 0.0000000000 T T F
|
||
|
0.8668913098 0.4369914014 0.0000000000 T T F
|
||
|
0.8280763696 0.5714502982 0.0000000000 T T F
|
||
|
0.6922240844 0.6050650174 0.0000000000 T T F
|
||
|
0.6534091443 0.7395239141 0.0000000000 T T F
|
||
|
0.5175568591 0.7731386333 0.0000000000 T T F
|
||
|
0.4787419190 0.9075975301 0.0000000000 T T F
|
||
|
0.3428896338 0.9412122492 0.0000000000 T T F
|
||
|
0.3040746937 1.0756711460 0.0000000000 T T F
|
||
|
0.1682224084 1.1092858652 0.0000000000 T T F
|
||
|
0.1294074683 1.2437447619 0.0000000000 T T F
|
||
|
1.0997809435 0.5042208478 0.0000000000 T T F
|
||
|
1.0609660034 0.6386797446 0.0000000000 T T F
|
||
|
0.9251137182 0.6722944637 0.0000000000 T T F
|
||
|
0.8862987781 0.8067533605 0.0000000000 T T F
|
||
|
0.7504464929 0.8403680797 0.0000000000 T T F
|
||
|
0.7116315528 0.9748269764 0.0000000000 T T F
|
||
|
0.5757792675 1.0084416956 0.0000000000 T T F
|
||
|
0.5369643274 1.1429005924 0.0000000000 T T F
|
||
|
0.4011120422 1.1765153116 0.0000000000 T T F
|
||
|
0.3622971021 1.3109742083 0.0000000000 T T F
|
||
|
0.2264448169 1.3445889275 0.0000000000 T T F
|
||
|
0.1876298768 1.4790478242 0.0000000000 T T F
|
||
|
0.0517775916 1.5126625434 0.0000000000 T T F
|
||
|
0.0129626514 1.6471214402 0.0000000000 T T F
|
||
|
1.1580033520 0.7395239101 0.0000000000 T T F
|
||
|
1.1191884118 0.8739828069 0.0000000000 T T F
|
||
|
0.9833361266 0.9075975261 0.0000000000 T T F
|
||
|
0.9445211865 1.0420564228 0.0000000000 T T F
|
||
|
0.8086689013 1.0756711420 0.0000000000 T T F
|
||
|
0.7698539612 1.2101300387 0.0000000000 T T F
|
||
|
0.6340016760 1.2437447579 0.0000000000 T T F
|
||
|
0.5951867359 1.3782036547 0.0000000000 T T F
|
||
|
0.4593344507 1.4118183739 0.0000000000 T T F
|
||
|
0.4205195105 1.5462772706 0.0000000000 T T F
|
||
|
0.2846672253 1.5798919898 0.0000000000 T T F
|
||
|
0.2458522852 1.7143508866 0.0000000000 T T F
|
||
|
0.1100000000 1.7479656057 0.0000000000 T T F
|
||
|
1.2162257604 0.9748269724 0.0000000000 T T F
|
||
|
1.1774108203 1.1092858692 0.0000000000 T T F
|
||
|
1.0415585351 1.1429005884 0.0000000000 T T F
|
||
|
1.0027435950 1.2773594851 0.0000000000 T T F
|
||
|
0.8668913098 1.3109742043 0.0000000000 T T F
|
||
|
0.8280763696 1.4454331011 0.0000000000 T T F
|
||
|
0.6922240844 1.4790478202 0.0000000000 T T F
|
||
|
0.6534091443 1.6135067170 0.0000000000 T T F
|
||
|
0.5175568591 1.6471214362 0.0000000000 T T F
|
||
|
1.0997809435 1.3782036507 0.0000000000 T T F
|
||
|
1.0609660034 1.5126625474 0.0000000000 T T F
|
||
|
0.9251137182 1.5462772666 0.0000000000 T T F
|
||
|
0.8862987781 1.6807361634 0.0000000000 T T F
|
||
|
0.7504464929 1.7143508825 0.0000000000 T T F
|
||
|
1.1580033520 1.6135067130 0.0000000000 T T F
|