360 Lattice="12.218805134296414 0.0 0.0 0.0 12.218805134296414 0.0 0.0 0.0 81.45870089530943" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1394.6154478588596 stress="0.0016671203951209733 6.03621877435419e-11 1.3533652112995332e-06 6.03621877435419e-11 0.0016671203933775836 1.3748939167727294e-06 1.3533652112995332e-06 1.3748939167727294e-06 4.272216118853023e-07" free_energy=-1394.6154478588596 pbc="T T F" Au -0.00104190 0.00616432 20.46532009 0.00000598 0.00000651 0.00000137 Au 2.03542891 0.00616764 22.38376750 0.00000602 0.00000626 0.00000243 Au -0.00103849 2.04263514 22.38376802 0.00000533 0.00000662 0.00000195 Au 2.03542579 2.04263185 20.46531984 0.00000590 0.00000647 0.00000160 Au -0.00102690 0.00618049 24.44730078 0.00000498 0.00000559 0.00000164 Au 2.03545458 0.00619601 26.47813967 0.00000450 0.00000483 0.00000154 Au -0.00101280 2.04266353 26.47813976 0.00000438 0.00000482 0.00000147 Au 2.03544058 2.04264796 24.44730060 0.00000506 0.00000564 0.00000180 Au -0.00099439 0.00621638 28.51580568 0.00000381 0.00000384 0.00000132 Au 2.03549475 0.00623987 30.55202150 0.00000317 0.00000288 0.00000100 Au -0.00097272 2.04270742 30.55202139 0.00000312 0.00000285 0.00000108 Au 2.03547311 2.04268384 28.51580572 0.00000381 0.00000391 0.00000130 Au -0.00094834 0.00626591 32.58854436 0.00000252 0.00000194 0.00000087 Au 2.03554578 0.00629359 34.62500247 0.00000184 0.00000115 0.00000063 Au -0.00092174 2.04276116 34.62500242 0.00000183 0.00000110 0.00000067 Au 2.03551923 2.04273344 32.58854444 0.00000247 0.00000194 0.00000081 Au -0.00089362 0.00632226 36.66147441 0.00000118 0.00000049 0.00000044 Au 2.03560305 0.00635135 38.69794351 0.00000050 -0.00000004 0.00000020 Au -0.00086446 2.04281888 38.69794356 0.00000047 -0.00000006 0.00000017 Au 2.03557392 2.04278981 36.66147441 0.00000117 0.00000046 0.00000043 Au -0.00083489 0.00638040 40.73441349 -0.00000024 -0.00000051 -0.00000011 Au 2.03566197 0.00640903 42.77088263 -0.00000094 -0.00000099 -0.00000036 Au -0.00080554 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0.00000287 0.00000103 Au -0.00097266 6.11564246 30.55202135 0.00000305 0.00000286 0.00000111 Au 2.03547315 6.11561898 28.51580570 0.00000376 0.00000382 0.00000131 Au -0.00094826 4.07920100 32.58854434 0.00000243 0.00000189 0.00000088 Au 2.03554582 4.07922869 34.62500249 0.00000179 0.00000109 0.00000061 Au -0.00092172 6.11569619 34.62500246 0.00000181 0.00000110 0.00000063 Au 2.03551928 6.11566851 32.58854443 0.00000241 0.00000189 0.00000081 Au -0.00089359 4.07925735 36.66147445 0.00000116 0.00000044 0.00000040 Au 2.03560306 4.07928643 38.69794356 0.00000049 -0.00000008 0.00000016 Au -0.00086448 6.11575392 38.69794364 0.00000050 -0.00000005 0.00000010 Au 2.03557396 6.11572487 36.66147449 0.00000114 0.00000044 0.00000036 Au -0.00083491 4.07931542 40.73441354 -0.00000022 -0.00000049 -0.00000015 Au 2.03566197 4.07934403 42.77088265 -0.00000094 -0.00000096 -0.00000038 Au -0.00080556 6.11581155 42.77088267 -0.00000093 -0.00000094 -0.00000040 Au 2.03563261 6.11578296 40.73441350 -0.00000022 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10.18855403 28.51580572 0.00000384 0.00000381 0.00000129 Au -0.00094830 8.15213598 32.58854435 0.00000247 0.00000195 0.00000088 Au 2.03554582 8.15216370 34.62500251 0.00000179 0.00000111 0.00000059 Au -0.00092178 10.18863118 34.62500244 0.00000187 0.00000117 0.00000065 Au 2.03551922 10.18860352 32.58854445 0.00000248 0.00000193 0.00000081 Au -0.00089362 8.15219235 36.66147448 0.00000119 0.00000048 0.00000037 Au 2.03560307 8.15222144 38.69794359 0.00000048 -0.00000005 0.00000014 Au -0.00086448 10.18868895 38.69794359 0.00000050 -0.00000004 0.00000014 Au 2.03557393 10.18865986 36.66147444 0.00000116 0.00000050 0.00000040 Au -0.00083492 8.15225048 40.73441355 -0.00000021 -0.00000050 -0.00000015 Au 2.03566198 8.15227909 42.77088263 -0.00000095 -0.00000095 -0.00000036 Au -0.00080552 10.18874665 42.77088265 -0.00000097 -0.00000098 -0.00000038 Au 2.03563261 10.18871801 40.73441346 -0.00000022 -0.00000049 -0.00000008 Au -0.00077697 8.15230689 44.80735461 -0.00000168 -0.00000150 -0.00000060 Au 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-0.00000137 Au 4.07223266 10.18884757 50.91655156 -0.00000383 -0.00000364 -0.00000144 Au 6.10867779 10.18882554 48.88033583 -0.00000307 -0.00000288 -0.00000114 Au 4.07225190 8.15239910 52.95421739 -0.00000461 -0.00000448 -0.00000143 Au 6.10873419 8.15241366 54.98505644 -0.00000534 -0.00000522 -0.00000147 Au 4.07226652 10.18888105 54.98505606 -0.00000527 -0.00000511 -0.00000130 Au 6.10871958 10.18886653 52.95421735 -0.00000473 -0.00000441 -0.00000139 Au 4.07227857 8.15242567 57.04858922 -0.00000595 -0.00000597 -0.00000225 Au 6.10874906 8.15242899 58.96703723 -0.00000607 -0.00000609 -0.00000143 Au 4.07228174 10.18889663 58.96703674 -0.00000626 -0.00000636 -0.00000104 Au 6.10874614 10.18889318 57.04858906 -0.00000586 -0.00000614 -0.00000244 Au 8.14482856 0.00616433 20.46532043 0.00000576 0.00000646 0.00000098 Au 10.18129900 0.00616764 22.38376830 0.00000583 0.00000646 0.00000197 Au 8.14483141 2.04263517 22.38376841 0.00000589 0.00000646 0.00000186 Au 10.18129583 2.04263188 20.46532046 0.00000608 0.00000658 0.00000140 Au 8.14484294 0.00618048 24.44730104 0.00000525 0.00000566 0.00000149 Au 10.18132469 0.00619604 26.47813982 0.00000449 0.00000480 0.00000143 Au 8.14485701 2.04266355 26.47813985 0.00000459 0.00000482 0.00000140 Au 10.18131065 2.04264802 24.44730111 0.00000507 0.00000560 0.00000130 Au 8.14487562 0.00621638 28.51580562 0.00000384 0.00000385 0.00000138 Au 10.18136487 0.00623990 30.55202130 0.00000314 0.00000285 0.00000115 Au 8.14489735 2.04270743 30.55202126 0.00000313 0.00000283 0.00000118 Au 10.18134323 2.04268392 28.51580562 0.00000378 0.00000382 0.00000138 Au 8.14492185 0.00626591 32.58854425 0.00000243 0.00000193 0.00000096 Au 10.18141588 0.00629360 34.62500237 0.00000183 0.00000113 0.00000071 Au 8.14494842 2.04276115 34.62500236 0.00000178 0.00000111 0.00000071 Au 10.18138933 2.04273348 32.58854425 0.00000247 0.00000188 0.00000095 Au 8.14497656 0.00632227 36.66147440 0.00000112 0.00000048 0.00000044 Au 10.18147318 0.00635135 38.69794358 0.00000045 -0.00000005 0.00000016 Au 8.14500567 2.04281885 38.69794357 0.00000045 -0.00000001 0.00000016 Au 10.18144405 2.04278981 36.66147441 0.00000113 0.00000047 0.00000044 Au 8.14503516 0.00638040 40.73441350 -0.00000021 -0.00000051 -0.00000011 Au 10.18153204 0.00640901 42.77088267 -0.00000093 -0.00000096 -0.00000039 Au 8.14506445 2.04287646 42.77088267 -0.00000087 -0.00000090 -0.00000039 Au 10.18150271 2.04284788 40.73441353 -0.00000024 -0.00000046 -0.00000014 Au 8.14509297 0.00643678 44.80735468 -0.00000155 -0.00000147 -0.00000064 Au 10.18158772 0.00646328 46.84381275 -0.00000235 -0.00000212 -0.00000084 Au 8.14512014 2.04293075 46.84381281 -0.00000229 -0.00000207 -0.00000089 Au 10.18156056 2.04290426 44.80735468 -0.00000160 -0.00000144 -0.00000064 Au 8.14514534 0.00648790 48.88033580 -0.00000311 -0.00000284 -0.00000111 Au 10.18163528 0.00651000 50.91655148 -0.00000389 -0.00000368 -0.00000137 Au 8.14516783 2.04297761 50.91655151 -0.00000394 -0.00000373 -0.00000140 Au 10.18161282 2.04295547 48.88033574 -0.00000307 -0.00000288 -0.00000106 Au 8.14518712 0.00652899 52.95421735 -0.00000478 -0.00000446 -0.00000140 Au 10.18166911 0.00654354 54.98505632 -0.00000538 -0.00000527 -0.00000146 Au 8.14520170 2.04301123 54.98505619 -0.00000542 -0.00000527 -0.00000131 Au 10.18165445 2.04299672 52.95421741 -0.00000461 -0.00000462 -0.00000148 Au 8.14521364 0.00655554 57.04858904 -0.00000565 -0.00000571 -0.00000219 Au 10.18168431 0.00655888 58.96703707 -0.00000609 -0.00000611 -0.00000164 Au 8.14521654 2.04302614 58.96703692 -0.00000563 -0.00000594 -0.00000145 Au 10.18168113 2.04302315 57.04858917 -0.00000610 -0.00000574 -0.00000190 Au 8.14482856 4.07909938 20.46532054 0.00000580 0.00000640 0.00000108 Au 10.18129902 4.07910273 22.38376853 0.00000592 0.00000606 0.00000150 Au 8.14483142 6.11557019 22.38376851 0.00000570 0.00000663 0.00000160 Au 10.18129584 6.11556680 20.46532052 0.00000593 0.00000654 0.00000115 Au 8.14484292 4.07911555 24.44730118 0.00000520 0.00000555 0.00000131 Au 10.18132474 4.07913108 26.47813986 0.00000441 0.00000480 0.00000140 Au 8.14485698 6.11559861 26.47813987 0.00000461 0.00000481 0.00000138 Au 10.18131067 6.11558307 24.44730116 0.00000502 0.00000563 0.00000135 Au 8.14487558 4.07915142 28.51580559 0.00000388 0.00000385 0.00000139 Au 10.18136492 4.07917495 30.55202124 0.00000309 0.00000284 0.00000120 Au 8.14489732 6.11564242 30.55202122 0.00000316 0.00000290 0.00000122 Au 10.18134325 6.11561893 28.51580559 0.00000375 0.00000388 0.00000140 Au 8.14492182 4.07920097 32.58854423 0.00000246 0.00000192 0.00000098 Au 10.18141590 4.07922868 34.62500238 0.00000180 0.00000110 0.00000069 Au 8.14494841 6.11569614 34.62500239 0.00000179 0.00000116 0.00000068 Au 10.18138934 6.11566846 32.58854423 0.00000245 0.00000195 0.00000097 Au 8.14497656 4.07925730 36.66147445 0.00000111 0.00000050 0.00000040 Au 10.18147317 4.07928637 38.69794364 0.00000046 -0.00000001 0.00000011 Au 8.14500568 6.11575388 38.69794367 0.00000043 0.00000000 0.00000008 Au 10.18144403 6.11572482 36.66147449 0.00000116 0.00000049 0.00000037 Au 8.14503517 4.07931536 40.73441355 -0.00000023 -0.00000042 -0.00000015 Au 10.18153202 4.07934398 42.77088269 -0.00000090 -0.00000090 -0.00000041 Au 8.14506447 6.11581153 42.77088268 -0.00000089 -0.00000093 -0.00000040 Au 10.18150269 6.11578293 40.73441360 -0.00000021 -0.00000047 -0.00000020 Au 8.14509298 4.07937176 44.80735466 -0.00000156 -0.00000143 -0.00000063 Au 10.18158768 4.07939829 46.84381268 -0.00000230 -0.00000210 -0.00000079 Au 8.14512015 6.11586586 46.84381264 -0.00000230 -0.00000215 -0.00000077 Au 10.18156056 6.11583933 44.80735460 -0.00000160 -0.00000148 -0.00000059 Au 8.14514533 4.07942301 48.88033570 -0.00000309 -0.00000291 -0.00000104 Au 10.18163521 4.07944522 50.91655144 -0.00000381 -0.00000380 -0.00000134 Au 8.14516783 6.11591272 50.91655141 -0.00000394 -0.00000380 -0.00000131 Au 10.18161283 6.11589053 48.88033555 -0.00000307 -0.00000291 -0.00000092 Au 8.14518710 4.07946436 52.95421744 -0.00000475 -0.00000469 -0.00000147 Au 10.18166905 4.07947886 54.98505657 -0.00000529 -0.00000532 -0.00000157 Au 8.14520172 6.11594634 54.98505673 -0.00000545 -0.00000537 -0.00000189 Au 10.18165446 6.11593178 52.95421757 -0.00000463 -0.00000462 -0.00000157 Au 8.14521361 4.07949081 57.04858946 -0.00000548 -0.00000647 -0.00000272 Au 10.18168427 4.07949355 58.96703739 -0.00000591 -0.00000599 -0.00000203 Au 8.14521658 6.11596125 58.96703746 -0.00000594 -0.00000617 -0.00000092 Au 10.18168108 6.11595831 57.04859007 -0.00000539 -0.00000666 -0.00000329 Au 8.14482856 8.15203428 20.46532039 0.00000571 0.00000665 0.00000170 Au 10.18129906 8.15203772 22.38376839 0.00000530 0.00000643 0.00000173 Au 8.14483143 10.18850529 22.38376831 0.00000565 0.00000588 0.00000174 Au 10.18129582 10.18850187 20.46532039 0.00000589 0.00000641 0.00000122 Au 8.14484293 8.15205060 24.44730112 0.00000523 0.00000563 0.00000125 Au 10.18132472 8.15206614 26.47813984 0.00000446 0.00000484 0.00000141 Au 8.14485702 10.18853366 26.47813983 0.00000460 0.00000482 0.00000142 Au 10.18131062 10.18851812 24.44730103 0.00000512 0.00000561 0.00000142 Au 8.14487559 8.15208645 28.51580560 0.00000386 0.00000388 0.00000139 Au 10.18136489 8.15210992 30.55202125 0.00000311 0.00000292 0.00000119 Au 8.14489736 10.18857747 30.55202127 0.00000311 0.00000290 0.00000118 Au 10.18134320 10.18855398 28.51580562 0.00000381 0.00000386 0.00000137 Au 8.14492183 8.15213594 32.58854423 0.00000245 0.00000200 0.00000098 Au 10.18141587 8.15216364 34.62500240 0.00000183 0.00000118 0.00000068 Au 8.14494843 10.18863117 34.62500238 0.00000177 0.00000117 0.00000070 Au 10.18138930 10.18860347 32.58854426 0.00000249 0.00000199 0.00000095 Au 8.14497656 8.15219233 36.66147448 0.00000111 0.00000051 0.00000037 Au 10.18147315 8.15222143 38.69794367 0.00000049 -0.00000004 0.00000008 Au 8.14500567 10.18868898 38.69794361 0.00000044 -0.00000006 0.00000013 Au 10.18144402 10.18865986 36.66147444 0.00000117 0.00000050 0.00000041 Au 8.14503517 8.15225049 40.73441357 -0.00000023 -0.00000051 -0.00000017 Au 10.18153203 8.15227912 42.77088267 -0.00000092 -0.00000098 -0.00000040 Au 8.14506446 10.18874666 42.77088265 -0.00000087 -0.00000100 -0.00000037 Au 10.18150270 10.18871803 40.73441355 -0.00000023 -0.00000053 -0.00000015 Au 8.14509299 8.15230693 44.80735460 -0.00000157 -0.00000154 -0.00000058 Au 10.18158773 8.15233340 46.84381259 -0.00000235 -0.00000216 -0.00000073 Au 8.14512015 10.18880093 46.84381272 -0.00000230 -0.00000216 -0.00000082 Au 10.18156059 10.18877445 44.80735462 -0.00000164 -0.00000153 -0.00000060 Au 8.14514535 8.15235806 48.88033560 -0.00000311 -0.00000292 -0.00000096 Au 10.18163528 8.15238011 50.91655138 -0.00000389 -0.00000368 -0.00000128 Au 8.14516785 10.18884756 50.91655145 -0.00000396 -0.00000364 -0.00000134 Au 10.18161288 10.18882553 48.88033564 -0.00000313 -0.00000287 -0.00000098 Au 8.14518713 8.15239914 52.95421752 -0.00000477 -0.00000452 -0.00000150 Au 10.18166913 8.15241365 54.98505686 -0.00000539 -0.00000520 -0.00000205 Au 8.14520174 10.18888106 54.98505645 -0.00000547 -0.00000519 -0.00000154 Au 10.18165452 10.18886654 52.95421748 -0.00000470 -0.00000443 -0.00000150 Au 8.14521374 8.15242567 57.04858993 -0.00000652 -0.00000554 -0.00000353 Au 10.18168431 8.15242898 58.96703761 -0.00000589 -0.00000610 -0.00000103 Au 8.14521660 10.18889662 58.96703722 -0.00000599 -0.00000614 -0.00000130 Au 10.18168117 10.18889311 57.04858966 -0.00000593 -0.00000531 -0.00000287