504 Lattice="15.329999957644777 0.0 0.0 0.0 10.839946925640108 0.0 0.0 0.0 71.53999980234227" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1754.9927313055534 stress="0.0007256907229051787 5.4430371996968745e-12 -1.7715183511909139e-06 5.4430371996968745e-12 6.114697834461863e-05 5.5864138138751164e-08 -1.7715183511909139e-06 5.5864138138751164e-08 1.1312518702319133e-07" free_energy=-1754.9927313055534 pbc="T T F" Cu 0.00651274 0.00655223 17.99763845 -0.00000519 -0.00000288 -0.00000021 Cu 2.56151252 0.00655218 17.99763774 -0.00000508 -0.00000274 0.00000018 Cu 1.28400858 1.81320946 19.15697764 -0.00000515 -0.00000267 -0.00000010 Cu 3.83900859 1.81320941 19.15697651 -0.00000537 -0.00000261 0.00000047 Cu 2.56149914 0.00654996 20.46093073 -0.00000540 -0.00000226 0.00000019 Cu 5.11649913 0.00654994 20.46092962 -0.00000540 -0.00000229 0.00000069 Cu 3.83898667 1.81320590 21.70575769 -0.00000549 -0.00000184 0.00000041 Cu 6.39398660 1.81320590 21.70575688 -0.00000552 -0.00000184 0.00000075 Cu 5.11646691 0.00654530 23.00451347 -0.00000554 -0.00000125 0.00000056 Cu 7.67146680 0.00654531 23.00451312 -0.00000547 -0.00000127 0.00000069 Cu 6.39394439 1.81320033 24.27241137 -0.00000538 -0.00000068 0.00000058 Cu 8.94894425 1.81320035 24.27241146 -0.00000530 -0.00000070 0.00000053 Cu 7.67141612 0.00653935 25.55528336 -0.00000503 -0.00000004 0.00000049 Cu 10.22641601 0.00653937 25.55528375 -0.00000498 -0.00000007 0.00000037 Cu 8.94888435 1.81319410 26.82956638 -0.00000448 0.00000057 0.00000034 Cu 11.50388430 1.81319412 26.82956688 -0.00000447 0.00000057 0.00000023 Cu 10.22634818 0.00653331 28.10884780 -0.00000381 0.00000114 0.00000023 Cu 12.78134820 0.00653334 28.10884826 -0.00000384 0.00000112 0.00000016 Cu 11.50380903 1.81318849 29.38536986 -0.00000296 0.00000167 0.00000016 Cu 14.05880909 1.81318853 29.38537016 -0.00000300 0.00000160 0.00000015 Cu 12.78126713 0.00652849 30.66342612 -0.00000210 0.00000204 0.00000017 Cu 0.00626723 0.00652851 30.66342624 -0.00000214 0.00000201 0.00000019 Cu 14.05872347 1.81318467 31.94060768 -0.00000112 0.00000235 0.00000014 Cu 1.28372357 1.81318466 31.94060765 -0.00000117 0.00000237 0.00000014 Cu 0.00617877 0.00652584 33.21829729 -0.00000025 0.00000257 0.00000019 Cu 2.56117879 0.00652583 33.21829717 -0.00000026 0.00000259 0.00000015 Cu 1.28363379 1.81318333 34.49567095 0.00000056 0.00000275 0.00000006 Cu 3.83863379 1.81318331 34.49567078 0.00000056 0.00000276 -0.00000001 Cu 2.56108920 0.00652594 35.77327919 0.00000123 0.00000272 0.00000003 Cu 5.11608920 0.00652594 35.77327903 0.00000120 0.00000273 -0.00000009 Cu 3.83854561 1.81318491 37.05065277 0.00000177 0.00000260 -0.00000008 Cu 6.39354564 1.81318492 37.05065261 0.00000175 0.00000258 -0.00000016 Cu 5.11600349 0.00652896 38.32834232 0.00000213 0.00000233 -0.00000015 Cu 7.67100355 0.00652896 38.32834222 0.00000208 0.00000233 -0.00000019 Cu 6.39346323 1.81318925 39.60552366 0.00000244 0.00000196 -0.00000016 Cu 8.94846332 1.81318926 39.60552367 0.00000236 0.00000197 -0.00000015 Cu 7.67092496 0.00653445 40.88357969 0.00000267 0.00000148 -0.00000016 Cu 10.22592505 0.00653445 40.88357989 0.00000261 0.00000147 -0.00000015 Cu 8.94838922 1.81319564 42.16010149 0.00000290 0.00000096 -0.00000014 Cu 11.50338927 1.81319566 42.16010190 0.00000286 0.00000093 -0.00000017 Cu 10.22585571 0.00654153 43.43938279 0.00000317 0.00000029 -0.00000017 Cu 12.78085570 0.00654154 43.43938339 0.00000316 0.00000029 -0.00000032 Cu 11.50332552 1.81320303 44.71366588 0.00000353 -0.00000034 -0.00000027 Cu 14.05832543 1.81320305 44.71366651 0.00000358 -0.00000036 -0.00000048 Cu 12.78079764 0.00654896 45.99653825 0.00000402 -0.00000103 -0.00000046 Cu 0.00579754 0.00654896 45.99653865 0.00000410 -0.00000104 -0.00000063 Cu 14.05827445 1.81321002 47.26443677 0.00000457 -0.00000163 -0.00000072 Cu 1.28327436 1.81321000 47.26443671 0.00000466 -0.00000161 -0.00000068 Cu 0.00575318 0.00655538 48.56319319 0.00000522 -0.00000222 -0.00000085 Cu 2.56075306 0.00655537 48.56319257 0.00000526 -0.00000220 -0.00000054 Cu 1.28323915 1.81321530 49.80802062 0.00000568 -0.00000261 -0.00000088 Cu 3.83823911 1.81321528 49.80801952 0.00000569 -0.00000259 -0.00000028 Cu 2.56072820 0.00655934 51.11197382 0.00000606 -0.00000297 -0.00000065 Cu 5.11572820 0.00655933 51.11197254 0.00000601 -0.00000297 -0.00000003 Cu 3.83822354 1.81321780 52.27131251 0.00000611 -0.00000311 -0.00000031 Cu 6.39322338 1.81321778 52.27131152 0.00000618 -0.00000309 0.00000016 Cu 0.00651275 3.61986785 17.99763846 -0.00000520 -0.00000281 -0.00000028 Cu 2.56151254 3.61986782 17.99763776 -0.00000512 -0.00000277 0.00000023 Cu 1.28400858 5.42652507 19.15697767 -0.00000507 -0.00000263 -0.00000014 Cu 3.83900859 5.42652504 19.15697655 -0.00000544 -0.00000260 0.00000040 Cu 2.56149915 3.61986558 20.46093076 -0.00000542 -0.00000224 0.00000003 Cu 5.11649914 3.61986556 20.46092963 -0.00000541 -0.00000223 0.00000076 Cu 3.83898668 5.42652155 21.70575770 -0.00000551 -0.00000184 0.00000041 Cu 6.39398660 5.42652154 21.70575688 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30.66342628 -0.00000210 0.00000207 0.00000013 Cu 14.05872349 5.42650027 31.94060766 -0.00000116 0.00000243 0.00000016 Cu 1.28372359 5.42650025 31.94060767 -0.00000121 0.00000245 0.00000011 Cu 0.00617878 3.61984147 33.21829735 -0.00000025 0.00000260 0.00000010 Cu 2.56117880 3.61984144 33.21829725 -0.00000029 0.00000264 0.00000003 Cu 1.28363382 5.42649901 34.49567093 0.00000052 0.00000268 0.00000009 Cu 3.83863380 5.42649899 34.49567078 0.00000055 0.00000270 -0.00000001 Cu 2.56108919 3.61984159 35.77327922 0.00000123 0.00000270 -0.00000000 Cu 5.11608917 3.61984158 35.77327904 0.00000125 0.00000273 -0.00000011 Cu 3.83854562 5.42650061 37.05065276 0.00000176 0.00000251 -0.00000006 Cu 6.39354563 5.42650058 37.05065262 0.00000175 0.00000255 -0.00000017 Cu 5.11600347 3.61984461 38.32834231 0.00000217 0.00000231 -0.00000012 Cu 7.67100353 3.61984461 38.32834222 0.00000211 0.00000231 -0.00000018 Cu 6.39346324 5.42650489 39.60552368 0.00000241 0.00000196 -0.00000018 Cu 8.94846331 5.42650490 39.60552370 0.00000237 0.00000195 -0.00000019 Cu 7.67092497 3.61985007 40.88357969 0.00000266 0.00000151 -0.00000016 Cu 10.22592505 3.61985008 40.88357989 0.00000260 0.00000150 -0.00000015 Cu 8.94838923 5.42651128 42.16010151 0.00000289 0.00000096 -0.00000016 Cu 11.50338926 5.42651130 42.16010192 0.00000288 0.00000094 -0.00000020 Cu 10.22585570 3.61985714 43.43938278 0.00000317 0.00000034 -0.00000015 Cu 12.78085568 3.61985716 43.43938338 0.00000320 0.00000031 -0.00000029 Cu 11.50332551 5.42651866 44.71366588 0.00000354 -0.00000031 -0.00000026 Cu 14.05832543 5.42651865 44.71366651 0.00000359 -0.00000031 -0.00000049 Cu 12.78079764 3.61986458 45.99653825 0.00000403 -0.00000100 -0.00000046 Cu 0.00579755 3.61986457 45.99653866 0.00000409 -0.00000098 -0.00000065 Cu 14.05827447 5.42652564 47.26443675 0.00000455 -0.00000161 -0.00000071 Cu 1.28327437 5.42652563 47.26443670 0.00000464 -0.00000159 -0.00000067 Cu 0.00575319 3.61987102 48.56319321 0.00000520 -0.00000222 -0.00000088 Cu 2.56075307 3.61987100 48.56319258 0.00000525 -0.00000220 -0.00000057 Cu 1.28323916 5.42653098 49.80802059 0.00000565 -0.00000267 -0.00000085 Cu 3.83823912 5.42653095 49.80801951 0.00000569 -0.00000264 -0.00000025 Cu 2.56072820 3.61987501 51.11197380 0.00000609 -0.00000303 -0.00000061 Cu 5.11572820 3.61987498 51.11197253 0.00000599 -0.00000299 -0.00000002 Cu 3.83822354 5.42653346 52.27131251 0.00000610 -0.00000313 -0.00000032 Cu 6.39322338 5.42653343 52.27131153 0.00000618 -0.00000309 0.00000015 Cu 0.00651274 7.23318345 17.99763846 -0.00000519 -0.00000269 -0.00000022 Cu 2.56151251 7.23318343 17.99763778 -0.00000508 -0.00000277 0.00000013 Cu 1.28400859 9.03984074 19.15697762 -0.00000535 -0.00000267 -0.00000008 Cu 3.83900855 9.03984071 19.15697651 -0.00000513 -0.00000264 0.00000046 Cu 2.56149915 7.23318125 20.46093076 -0.00000542 -0.00000232 0.00000011 Cu 5.11649913 7.23318122 20.46092965 -0.00000541 -0.00000222 0.00000068 Cu 3.83898668 9.03983721 21.70575769 -0.00000553 -0.00000187 0.00000042 Cu 6.39398661 9.03983719 21.70575689 -0.00000551 -0.00000185 0.00000074 Cu 5.11646693 7.23317659 23.00451347 -0.00000558 -0.00000127 0.00000055 Cu 7.67146681 7.23317659 23.00451312 -0.00000550 -0.00000126 0.00000068 Cu 6.39394441 9.03983160 24.27241138 -0.00000542 -0.00000066 0.00000056 Cu 8.94894427 9.03983163 24.27241146 -0.00000533 -0.00000069 0.00000052 Cu 7.67141616 7.23317063 25.55528338 -0.00000511 -0.00000004 0.00000045 Cu 10.22641604 7.23317066 25.55528376 -0.00000502 -0.00000007 0.00000035 Cu 8.94888438 9.03982540 26.82956637 -0.00000453 0.00000055 0.00000035 Cu 11.50388433 9.03982543 26.82956688 -0.00000452 0.00000052 0.00000024 Cu 10.22634821 7.23316461 28.10884780 -0.00000386 0.00000112 0.00000024 Cu 12.78134821 7.23316460 28.10884825 -0.00000385 0.00000114 0.00000018 Cu 11.50380908 9.03981980 29.38536984 -0.00000303 0.00000162 0.00000019 Cu 14.05880913 9.03981979 29.38537015 -0.00000308 0.00000164 0.00000017 Cu 12.78126714 7.23315974 30.66342610 -0.00000212 0.00000208 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39.60552393 0.00000234 0.00000196 -0.00000010 Cu 14.05846329 1.81318927 39.60552420 0.00000238 0.00000195 -0.00000010 Cu 12.78092504 0.00653445 40.88358028 0.00000260 0.00000149 -0.00000016 Cu 0.00592498 0.00653444 40.88358049 0.00000267 0.00000150 -0.00000023 Cu 14.05838919 1.81319567 42.16010233 0.00000290 0.00000092 -0.00000026 Cu 1.28338910 1.81319567 42.16010230 0.00000301 0.00000091 -0.00000025 Cu 0.00585561 0.00654153 43.43938368 0.00000325 0.00000029 -0.00000041 Cu 2.56085548 0.00654152 43.43938333 0.00000335 0.00000030 -0.00000029 Cu 1.28332533 1.81320304 44.71366647 0.00000369 -0.00000036 -0.00000047 Cu 3.83832526 1.81320302 44.71366579 0.00000374 -0.00000033 -0.00000021 Cu 2.56079741 0.00654894 45.99653816 0.00000421 -0.00000103 -0.00000041 Cu 5.11579741 0.00654892 45.99653731 0.00000420 -0.00000100 -0.00000009 Cu 3.83827430 1.81320998 47.26443581 0.00000470 -0.00000159 -0.00000029 Cu 6.39327436 1.81320998 47.26443503 0.00000465 -0.00000158 0.00000003 Cu 5.11575307 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