504 Lattice="15.439340304477982 0.0 0.0 0.0 10.917262226343157 0.0 0.0 0.0 72.05025475423058" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1630.4131533224645 stress="0.0023562907748029827 4.985102291084285e-12 -1.966107664456777e-06 4.985102291084285e-12 0.0019065910467349649 9.044679026053098e-08 -1.966107664456777e-06 9.044679026053098e-08 3.1594881578415192e-09" free_energy=-1630.4131533224645 pbc="T T F" Cu 0.00663063 0.00653583 18.10437659 -0.00000814 0.00000033 -0.00000023 Cu 2.57985396 0.00653608 18.10437659 -0.00000807 0.00000013 0.00000007 Cu 1.29323681 1.82607965 19.31408492 -0.00000762 -0.00000030 -0.00000006 Cu 3.86646029 1.82607972 19.31408491 -0.00000827 -0.00000035 -0.00000021 Cu 2.57983477 0.00653596 20.59028294 -0.00000781 0.00000080 -0.00000053 Cu 5.15305813 0.00653602 20.59028275 -0.00000749 0.00000072 0.00000041 Cu 3.86642670 1.82607991 21.87586352 -0.00000663 -0.00000088 0.00000013 Cu 6.43965015 1.82607993 21.87586338 -0.00000781 -0.00000090 -0.00000022 Cu 5.15301081 0.00653611 23.16200661 -0.00000694 0.00000125 -0.00000076 Cu 7.72623414 0.00653617 23.16200640 -0.00000641 0.00000120 0.00000074 Cu 6.43958704 1.82608018 24.44888387 -0.00000510 -0.00000126 0.00000028 Cu 9.01281054 1.82608015 24.44888381 -0.00000685 -0.00000124 -0.00000027 Cu 7.72615740 0.00653642 25.73545266 -0.00000551 0.00000160 -0.00000097 Cu 10.29938075 0.00653644 25.73545247 -0.00000486 0.00000161 0.00000105 Cu 9.01272263 1.82608052 27.02206797 -0.00000311 -0.00000149 0.00000038 Cu 11.58594618 1.82608049 27.02206800 -0.00000542 -0.00000144 -0.00000031 Cu 10.29928408 0.00653682 28.30868415 -0.00000368 0.00000195 -0.00000121 Cu 12.87250741 0.00653682 28.30868404 -0.00000288 0.00000193 0.00000127 Cu 11.58584217 1.82608105 29.59529297 -0.00000084 -0.00000156 0.00000041 Cu 14.15906575 1.82608105 29.59529312 -0.00000359 -0.00000156 -0.00000043 Cu 12.87239844 0.00653745 30.88190579 -0.00000162 0.00000209 -0.00000147 Cu 0.00628146 0.00653748 30.88190569 -0.00000077 0.00000206 0.00000141 Cu 14.15895329 1.82608182 32.16851726 0.00000137 -0.00000152 0.00000039 Cu 1.29283661 1.82608183 32.16851735 -0.00000180 -0.00000155 -0.00000045 Cu 0.00616792 0.00653838 33.45512911 0.00000024 0.00000209 -0.00000166 Cu 2.57939127 0.00653841 33.45512887 0.00000107 0.00000207 0.00000163 Cu 1.29272318 1.82608286 34.74174074 0.00000318 -0.00000143 0.00000036 Cu 3.86594683 1.82608288 34.74174075 -0.00000030 -0.00000142 -0.00000041 Cu 2.57928011 0.00653960 36.02835252 0.00000174 0.00000193 -0.00000173 Cu 5.15250346 0.00653964 36.02835232 0.00000258 0.00000186 0.00000176 Cu 3.86583879 1.82608423 37.31496414 0.00000463 -0.00000130 0.00000042 Cu 6.43906242 1.82608427 37.31496426 0.00000103 -0.00000135 -0.00000040 Cu 5.15240046 0.00654114 38.60157602 0.00000299 0.00000158 -0.00000177 Cu 7.72562378 0.00654118 38.60157589 0.00000375 0.00000155 0.00000169 Cu 6.43896500 1.82608586 39.88818751 0.00000558 -0.00000121 0.00000030 Cu 9.01218863 1.82608585 39.88818760 0.00000203 -0.00000121 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3.64562484 30.88190570 -0.00000080 0.00000212 0.00000142 Cu 14.15895333 5.46516921 32.16851725 0.00000132 -0.00000152 0.00000038 Cu 1.29283663 5.46516920 32.16851736 -0.00000183 -0.00000149 -0.00000047 Cu 0.00616793 3.64562576 33.45512914 0.00000020 0.00000211 -0.00000170 Cu 2.57939129 3.64562576 33.45512889 0.00000106 0.00000210 0.00000162 Cu 1.29272321 5.46517028 34.74174071 0.00000315 -0.00000142 0.00000039 Cu 3.86594682 5.46517029 34.74174074 -0.00000029 -0.00000144 -0.00000038 Cu 2.57928010 3.64562700 36.02835253 0.00000177 0.00000194 -0.00000175 Cu 5.15250344 3.64562701 36.02835230 0.00000259 0.00000191 0.00000175 Cu 3.86583880 5.46517165 37.31496411 0.00000461 -0.00000132 0.00000043 Cu 6.43906242 5.46517163 37.31496426 0.00000104 -0.00000130 -0.00000040 Cu 5.15240043 3.64562853 38.60157601 0.00000302 0.00000159 -0.00000173 Cu 7.72562378 3.64562852 38.60157588 0.00000374 0.00000160 0.00000172 Cu 6.43896503 5.46517321 39.88818749 0.00000555 -0.00000117 0.00000032 Cu 9.01218863 5.46517319 39.88818759 0.00000203 -0.00000112 -0.00000041 Cu 7.72553346 3.64563022 41.17480039 0.00000375 0.00000119 -0.00000177 Cu 10.29875680 3.64563019 41.17480011 0.00000443 0.00000121 0.00000161 Cu 9.01210552 5.46517493 42.46140915 0.00000589 -0.00000104 0.00000023 Cu 11.58532910 5.46517491 42.46140904 0.00000269 -0.00000104 -0.00000029 Cu 10.29868187 3.64563197 43.74802535 0.00000418 0.00000072 -0.00000154 Cu 12.87190521 3.64563193 43.74802494 0.00000471 0.00000075 0.00000150 Cu 11.58526218 5.46517660 45.03464051 0.00000592 -0.00000099 0.00000025 Cu 14.15848574 5.46517655 45.03464038 0.00000320 -0.00000094 -0.00000019 Cu 12.87184698 3.64563354 46.32120926 0.00000448 0.00000029 -0.00000116 Cu 0.00573006 3.64563351 46.32120897 0.00000488 0.00000033 0.00000126 Cu 14.15843630 5.46517796 47.60808648 0.00000580 -0.00000087 0.00000021 Cu 1.29231953 5.46517796 47.60808643 0.00000369 -0.00000085 -0.00000012 Cu 0.00569076 3.64563477 48.89422962 0.00000464 -0.00000007 -0.00000076 Cu 2.57891416 3.64563479 48.89422951 0.00000492 -0.00000009 0.00000093 Cu 1.29229060 5.46517894 50.17981022 0.00000538 -0.00000076 0.00000017 Cu 3.86551406 5.46517900 50.17981036 0.00000417 -0.00000083 -0.00000006 Cu 2.57889422 3.64563549 51.45600824 0.00000468 -0.00000038 -0.00000022 Cu 5.15211758 3.64563549 51.45600838 0.00000482 -0.00000039 0.00000041 Cu 3.86550274 5.46517926 52.66571661 0.00000484 -0.00000056 0.00000010 Cu 6.43872612 5.46517922 52.66571691 0.00000465 -0.00000054 -0.00000012 Cu 0.00663070 7.28471075 18.10437655 -0.00000819 0.00000026 -0.00000020 Cu 2.57985402 7.28471078 18.10437649 -0.00000811 0.00000022 0.00000016 Cu 1.29323694 9.10425451 19.31408482 -0.00000772 -0.00000031 0.00000002 Cu 3.86646032 9.10425462 19.31408470 -0.00000829 -0.00000041 -0.00000005 Cu 2.57983480 7.28471076 20.59028277 -0.00000782 0.00000079 -0.00000041 Cu 5.15305814 7.28471080 20.59028257 -0.00000753 0.00000076 0.00000054 Cu 3.86642673 9.10425464 21.87586338 -0.00000665 -0.00000080 0.00000023 Cu 6.43965019 9.10425469 21.87586331 -0.00000785 -0.00000084 -0.00000018 Cu 5.15301086 7.28471094 23.16200652 -0.00000698 0.00000125 -0.00000068 Cu 7.72623422 7.28471094 23.16200636 -0.00000647 0.00000125 0.00000079 Cu 6.43958710 9.10425493 24.44888383 -0.00000514 -0.00000123 0.00000033 Cu 9.01281059 9.10425498 24.44888380 -0.00000691 -0.00000126 -0.00000023 Cu 7.72615748 7.28471123 25.73545264 -0.00000557 0.00000163 -0.00000098 Cu 10.29938079 7.28471121 25.73545245 -0.00000490 0.00000163 0.00000109 Cu 9.01272268 9.10425535 27.02206793 -0.00000318 -0.00000149 0.00000040 Cu 11.58594620 9.10425534 27.02206797 -0.00000541 -0.00000149 -0.00000030 Cu 10.29928410 7.28471166 28.30868410 -0.00000367 0.00000190 -0.00000117 Cu 12.87250741 7.28471161 28.30868401 -0.00000291 0.00000196 0.00000129 Cu 11.58584222 9.10425586 29.59529293 -0.00000087 -0.00000155 0.00000047 Cu 14.15906577 9.10425586 29.59529310 -0.00000361 -0.00000154 -0.00000041 Cu 12.87239847 7.28471225 30.88190576 -0.00000165 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2.57950492 0.00653750 30.88190585 -0.00000162 0.00000206 -0.00000146 Cu 5.15272827 0.00653750 30.88190561 -0.00000079 0.00000204 0.00000151 Cu 3.86605983 1.82608184 32.16851723 0.00000130 -0.00000156 0.00000045 Cu 6.43928343 1.82608185 32.16851728 -0.00000184 -0.00000156 -0.00000040 Cu 5.15261474 0.00653842 33.45512908 0.00000018 0.00000203 -0.00000163 Cu 7.72583807 0.00653839 33.45512890 0.00000106 0.00000208 0.00000159 Cu 6.43917000 1.82608291 34.74174072 0.00000314 -0.00000144 0.00000042 Cu 9.01239359 1.82608291 34.74174077 -0.00000030 -0.00000147 -0.00000043 Cu 7.72572690 0.00653965 36.02835261 0.00000173 0.00000186 -0.00000176 Cu 10.29895020 0.00653961 36.02835232 0.00000259 0.00000191 0.00000175 Cu 9.01228557 1.82608427 37.31496422 0.00000462 -0.00000135 0.00000039 Cu 11.58550918 1.82608423 37.31496418 0.00000100 -0.00000130 -0.00000034 Cu 10.29884719 0.00654114 38.60157606 0.00000300 0.00000159 -0.00000177 Cu 12.87207052 0.00654108 38.60157573 0.00000376 0.00000163 0.00000178 Cu 11.58541179 1.82608580 39.88818742 0.00000553 -0.00000115 0.00000036 Cu 14.15863540 1.82608577 39.88818739 0.00000202 -0.00000112 -0.00000034 Cu 12.87198021 0.00654278 41.17480017 0.00000377 0.00000120 -0.00000165 Cu 0.00586326 0.00654275 41.17479990 0.00000442 0.00000125 0.00000167 Cu 14.15855228 1.82608748 42.46140888 0.00000592 -0.00000101 0.00000034 Cu 1.29243558 1.82608749 42.46140887 0.00000266 -0.00000104 -0.00000026 Cu 0.00578835 0.00654452 43.74802506 0.00000416 0.00000075 -0.00000146 Cu 2.57901171 0.00654453 43.74802485 0.00000470 0.00000074 0.00000155 Cu 1.29236866 1.82608916 45.03464028 0.00000595 -0.00000097 0.00000030 Cu 3.86559226 1.82608918 45.03464040 0.00000313 -0.00000098 -0.00000018 Cu 2.57895349 0.00654613 46.32120915 0.00000445 0.00000029 -0.00000115 Cu 5.15217686 0.00654611 46.32120916 0.00000487 0.00000029 0.00000123 Cu 3.86554281 1.82609057 47.60808647 0.00000578 -0.00000088 0.00000025 Cu 6.43876632 1.82609058 47.60808674 0.00000366 -0.00000090 -0.00000022 Cu 5.15213754 0.00654735 48.89422983 0.00000464 -0.00000008 -0.00000082 Cu 7.72536091 0.00654732 48.89422994 0.00000494 -0.00000005 0.00000075 Cu 6.43873736 1.82609155 50.17981049 0.00000539 -0.00000079 0.00000013 Cu 9.01196081 1.82609155 50.17981060 0.00000419 -0.00000079 -0.00000014 Cu 7.72534098 0.00654820 51.45600870 0.00000467 -0.00000047 -0.00000040 Cu 10.29856438 0.00654817 51.45600860 0.00000481 -0.00000044 0.00000032 Cu 9.01194955 1.82609200 52.66571692 0.00000484 -0.00000066 -0.00000001 Cu 11.58517300 1.82609200 52.66571675 0.00000460 -0.00000066 -0.00000000 Cu 5.15307736 3.64562316 18.10437642 -0.00000814 0.00000035 -0.00000012 Cu 7.72630078 3.64562330 18.10437627 -0.00000811 0.00000026 0.00000020 Cu 6.43968363 5.46516709 19.31408449 -0.00000766 -0.00000033 0.00000018 Cu 9.01290705 5.46516715 19.31408447 -0.00000827 -0.00000035 -0.00000000 Cu 7.72628156 3.64562341 20.59028259 -0.00000782 0.00000074 -0.00000041 Cu 10.29950493 3.64562336 20.59028242 -0.00000753 0.00000080 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28.30868402 -0.00000291 0.00000188 0.00000127 Cu 6.43939544 9.10425590 29.59529301 -0.00000086 -0.00000161 0.00000042 Cu 9.01261902 9.10425588 29.59529302 -0.00000361 -0.00000157 -0.00000038 Cu 7.72595169 7.28471234 30.88190581 -0.00000161 0.00000203 -0.00000147 Cu 10.29917502 7.28471230 30.88190554 -0.00000079 0.00000207 0.00000151 Cu 9.01250657 9.10425664 32.16851724 0.00000132 -0.00000154 0.00000040 Cu 11.58573016 9.10425661 32.16851724 -0.00000182 -0.00000152 -0.00000039 Cu 10.29906147 7.28471320 33.45512907 0.00000020 0.00000208 -0.00000163 Cu 12.87228481 7.28471317 33.45512882 0.00000104 0.00000213 0.00000166 Cu 11.58561672 9.10425767 34.74174067 0.00000318 -0.00000141 0.00000044 Cu 14.15884033 9.10425767 34.74174073 -0.00000028 -0.00000141 -0.00000040 Cu 12.87217362 7.28471439 36.02835251 0.00000177 0.00000196 -0.00000171 Cu 0.00605667 7.28471441 36.02835228 0.00000257 0.00000192 0.00000173 Cu 14.15873229 9.10425901 37.31496411 0.00000462 -0.00000127 0.00000040 Cu 1.29261565 9.10425903 37.31496416 0.00000103 -0.00000128 -0.00000038 Cu 0.00595366 7.28471593 38.60157595 0.00000301 0.00000160 -0.00000174 Cu 2.57917704 7.28471594 38.60157569 0.00000372 0.00000160 0.00000180 Cu 1.29251825 9.10426060 39.88818733 0.00000555 -0.00000114 0.00000035 Cu 3.86574190 9.10426063 39.88818740 0.00000200 -0.00000118 -0.00000030 Cu 2.57908671 7.28471762 41.17480011 0.00000376 0.00000119 -0.00000164 Cu 5.15231007 7.28471762 41.17479998 0.00000438 0.00000121 0.00000169 Cu 3.86565877 9.10426233 42.46140890 0.00000591 -0.00000106 0.00000034 Cu 6.43888237 9.10426235 42.46140910 0.00000264 -0.00000108 -0.00000032 Cu 5.15223512 7.28471938 43.74802518 0.00000417 0.00000073 -0.00000146 Cu 7.72545847 7.28471939 43.74802515 0.00000470 0.00000070 0.00000141 Cu 6.43881542 9.10426398 45.03464057 0.00000593 -0.00000098 0.00000022 Cu 9.01203899 9.10426397 45.03464069 0.00000319 -0.00000096 -0.00000031 Cu 7.72540024 7.28472100 46.32120956 0.00000446 0.00000023 -0.00000128 Cu 10.29862362 7.28472097 46.32120933 0.00000487 0.00000028 0.00000113 Cu 9.01198954 9.10426534 47.60808689 0.00000579 -0.00000086 0.00000006 Cu 11.58521307 9.10426533 47.60808673 0.00000369 -0.00000086 -0.00000021 Cu 10.29858431 7.28472222 48.89423013 0.00000464 -0.00000011 -0.00000097 Cu 12.87180768 7.28472216 48.89422974 0.00000491 -0.00000004 0.00000080 Cu 11.58518414 9.10426632 50.17981059 0.00000538 -0.00000075 0.00000005 Cu 14.15840758 9.10426631 50.17981036 0.00000417 -0.00000075 -0.00000009 Cu 12.87178772 7.28472286 51.45600859 0.00000470 -0.00000034 -0.00000040 Cu 0.00567081 7.28472285 51.45600832 0.00000483 -0.00000034 0.00000036 Cu 14.15839635 9.10426680 52.66571659 0.00000483 -0.00000063 0.00000009 Cu 1.29227938 9.10426679 52.66571651 0.00000465 -0.00000063 0.00000003