108 Lattice="10.557269145378712 0.0 0.0 0.0 10.557269145378712 0.0 0.0 0.0 10.557269145378712" Properties=species:S:1:pos:R:3:forces:R:3 energy=-312.2695658355051 stress="-0.008405671143091369 0.0013467082683643308 5.9456942831185284e-05 0.0013467082683643308 -0.008002913232304563 0.002181651875714019 5.9456942831185284e-05 0.002181651875714019 -0.00799238293440228" free_energy=-312.2695658355051 pbc="F F F" Ni 0.01974875 0.01251858 0.02266026 0.46141948 0.37630545 0.43939808 Ni 1.73918809 1.75677215 0.03189523 0.38968046 -0.13993129 -0.37676896 Ni 1.77809371 0.01338942 1.77963393 0.20259447 -0.26609189 -0.17692431 Cu 0.01362911 1.77382370 1.81021996 -1.04437389 -0.02741274 -0.27757321 Ni 3.54976304 0.00664700 0.01698371 -0.27172719 0.28646740 0.25451217 Cu 5.30603111 1.74689508 0.01231716 0.02661707 0.12162773 -0.65193735 Cu 5.25729593 0.01777528 1.79902562 0.11495510 -0.74841902 -0.18901379 Ni 3.52749797 1.78765761 1.73489816 -0.21544246 -0.22500174 0.29122073 Cu 7.02788465 0.02038450 0.01563002 -0.20926841 -0.01915475 0.01568548 Cu 8.82231224 1.74930576 0.01942634 -0.14974407 0.27955108 -0.01038230 Ni 8.78491673 0.02346800 1.74416490 -0.20437660 0.11682210 0.72361460 Cu 7.01590975 1.72788769 1.77178616 0.16007312 0.44027010 -0.12991549 Cu 0.03161601 3.54797038 0.00349453 -0.33267772 -0.13010696 -0.17408613 Cu 1.75642450 5.27039301 0.03205818 0.28330326 0.16791625 -0.71552630 Ni 1.73307544 3.50187919 1.73637576 0.55307148 0.18091314 0.38402488 Cu 0.00952719 5.29799091 1.73522143 -0.55518030 -0.14817109 0.44668830 Cu 3.53498657 3.48826051 0.00973640 -0.14627791 0.24529067 -1.09459796 Cu 5.29656288 5.24380391 0.02173686 -0.10445900 0.46432927 -0.97931891 Ni 5.25558645 3.55304765 1.74704013 0.19568941 -0.35096053 0.50623562 Ni 3.50513930 5.30098445 1.73675083 0.03346335 -0.32509433 0.36515333 Ni 7.04467918 3.53317542 0.02606368 -0.11588893 -0.44480726 -0.20454396 Cu 8.76875871 5.26752510 0.02106917 0.20425756 0.18125722 -0.09619767 Ni 8.79019901 3.52587124 1.78314508 0.29809321 -0.32740621 0.08470223 Cu 7.01394301 5.25752266 1.73832121 0.38161044 0.41218214 0.37877213 Cu 0.04774228 6.99111257 0.01988791 -0.05753495 0.08360997 -0.07322776 Cu 1.75853360 8.78072313 0.02014790 0.43290241 -0.10876499 -0.01213417 Cu 1.74144647 7.08214157 1.79469314 0.42501058 -0.40264567 -0.52346306 Ni 0.03076025 8.82486389 1.73500472 0.05722448 -0.13543053 0.45137450 Cu 3.55018958 7.01835931 0.00263646 -0.15000976 0.20518211 -0.40371444 Cu 5.29777919 8.80257223 0.00706515 0.00982249 -0.15843415 0.25726376 Cu 5.24572172 7.02743893 1.78199691 0.39703999 0.34661068 -0.33942274 Cu 3.54351036 8.80694866 1.78662881 -0.05103345 0.42786567 -0.28133641 Cu 7.04143008 7.04416017 0.02571055 -0.26969250 -0.09620962 -0.35308311 Ni 8.79694577 8.80917321 0.02868472 -0.35611787 -0.42434220 0.44319749 Ni 8.80150150 7.06177950 1.76449748 0.24843474 -0.24797308 0.36264243 Cu 7.05497016 8.80080781 1.79666860 -0.38491520 0.48784946 -0.17643735 Cu 0.02236575 0.02837335 3.54641306 -0.31303950 -0.29435786 -0.10986893 Ni 1.73918586 1.77123328 3.49488894 0.76442885 0.37355850 0.17093373 Cu 1.77115267 0.01899833 5.22090143 0.17545259 -0.72849371 0.41251870 Cu 0.02843190 1.73915272 5.28774535 -0.77365331 0.19879342 0.00498410 Cu 3.51195875 0.02880328 3.49301127 0.21936352 -0.67796516 0.29843407 Cu 5.31334074 1.76204484 3.51325131 -0.33053279 0.34435107 0.15667068 Ni 5.31085956 0.02889918 5.25073137 -0.29675620 -0.36164078 0.33842480 Cu 3.52870284 1.74671415 5.27807728 -0.10473710 0.29644924 -0.14186309 Ni 7.00353475 0.01532525 3.52227282 0.19930575 -0.50721113 -0.11945883 Ni 8.76591608 1.76337748 3.54558332 0.36351192 0.33251454 -0.40881568 Cu 8.76350016 0.01704172 5.24805888 0.37040133 -0.38572361 0.14145473 Cu 7.06621813 1.73377539 5.29563946 -0.34180389 0.58193468 -0.15788238 Cu 0.01493566 3.52041084 3.53896294 -0.90173885 0.18367522 -0.21135901 Cu 1.78474392 5.28937500 3.48521264 -0.23593501 -0.08299141 0.00642049 Ni 1.73476546 3.53823881 5.25531717 0.70395435 -0.21554859 0.20881030 Ni 0.00818469 5.27811983 5.26007187 -0.09110268 0.24587812 0.04359224 Cu 3.53348317 3.50471207 3.49626178 -0.02063320 -0.01223828 0.42995206 Ni 5.24481527 5.30587274 3.50288558 0.21129621 -0.50826257 0.31611875 Cu 5.29600471 3.48494412 5.29030595 -0.01433986 0.16123230 -0.27708816 Ni 3.51245711 5.25885458 5.27430166 0.08836343 0.04457101 0.25091179 Cu 7.02713350 3.53852747 3.52303001 -0.13414680 -0.12443564 0.11003760 Cu 8.82528610 5.23289749 3.52917828 0.59291317 0.26694839 -0.13516030 Ni 8.80087473 3.52861612 5.28297352 0.48172223 -0.56129177 -0.12310462 Cu 7.06634372 5.24462525 5.29386119 -0.54130030 0.28139804 -0.07813722 Cu 0.02788160 7.04659634 3.48979774 -0.81698266 -0.20018897 0.13922477 Ni 1.76688433 8.76915213 3.48867159 0.22414329 0.66747700 0.45823824 Ni 1.78146118 7.04830735 5.25570657 0.24652050 -0.24986950 0.44778330 Cu 0.02201917 8.76907072 5.28571042 -0.19548614 0.16850393 -0.08274775 Cu 3.51840323 7.03063538 3.52767187 -0.04315349 0.25577331 -0.07532455 Ni 5.27614053 8.79774222 3.51025048 0.15275162 0.35456763 0.51090974 Cu 5.25849353 7.05005845 5.25249130 0.24868548 -0.08367618 0.34059501 Ni 3.47551117 8.81884375 5.31606378 0.20744014 0.23792056 -0.12876304 Ni 7.06870357 7.00346446 3.52062424 -0.19592388 0.17636107 0.17502210 Ni 8.80150138 8.83077753 3.51440711 -0.20548940 -0.46996538 0.31007385 Ni 8.78212197 7.01232551 5.28215616 0.31001784 0.33291832 -0.19485678 Ni 7.05130130 8.76946980 5.28589745 -0.18124988 0.25504846 -0.27965678 Ni 0.00177927 0.01103546 7.04845874 0.35971676 0.09863220 -0.16098895 Ni 1.72676039 1.73379835 7.09251889 0.58358364 0.20189215 -0.33786408 Ni 1.75511710 0.03349713 8.83140627 0.36404163 0.10157401 -0.31767950 Ni 0.03144125 1.73262926 8.76442711 0.02046341 0.37325829 -0.02622085 Ni 3.51937129 0.04411130 7.04644176 0.15228541 -0.27661011 -0.01126368 Ni 5.28111328 1.77524371 7.06124918 -0.25045520 -0.34715604 -0.16428407 Ni 5.28855375 0.02196058 8.82919416 -0.26764606 0.13641738 -0.38895214 Ni 3.50063155 1.77385934 8.80283902 0.26722357 0.23796929 0.16885917 Ni 7.03032879 0.00355045 7.01282218 -0.26005186 -0.34011413 0.21792829 Ni 8.79119815 1.76092523 7.04692033 0.42376009 0.03747937 -0.16070653 Ni 8.76337919 0.02925230 8.81447391 -0.43697698 0.37317331 -0.55813115 Cu 7.00745653 1.75637064 8.76605865 0.18976586 0.24618679 0.79188374 Cu 0.03078113 3.53470112 7.00851892 -1.01956793 -0.15422549 0.19912917 Ni 1.74409884 5.24995858 7.06756395 0.50275061 0.15629389 -0.76617541 Ni 1.73598892 3.51408100 8.82217397 0.35398111 -0.14483814 0.19896643 Cu 0.02932678 5.30763818 8.79244021 -0.31849664 -0.12687282 0.16785010 Cu 3.53198465 3.52061580 7.01022648 -0.32287370 -0.32910553 0.14287103 Ni 5.23776634 5.26743170 7.04234085 0.41658306 0.31018946 -0.29377621 Ni 5.31190338 3.55215438 8.76939803 -0.18263814 -0.26702482 0.27640563 Cu 3.52534400 5.25230954 8.79052417 -0.22564884 0.02018493 0.96703647 Cu 7.07827536 3.52091653 7.01096601 -0.32467807 0.11057265 0.19074262 Cu 8.81833268 5.25281912 7.00529578 0.55903903 0.18052180 0.34767488 Cu 8.75177761 3.51586601 8.82182234 0.00590422 0.04839710 -0.00675442 Cu 7.05261598 5.30253757 8.76259530 0.03751699 -0.07047964 0.53024742 Cu 0.01065765 7.02890373 7.03496670 -0.59449031 0.03550850 -0.06335107 Ni 1.74786061 8.80893918 7.05351718 0.59553257 0.16699716 -0.28461920 Cu 1.73596410 7.02868336 8.77961235 0.32268863 0.06486803 0.73546909 Cu 0.02915175 8.79805877 8.79417423 0.21675368 -0.31353258 -0.23473941 Ni 3.52611681 7.02441251 7.06417936 0.08083813 0.21364374 -0.39635783 Ni 5.30861645 8.82435058 7.03778720 -0.19605746 0.05628455 -0.11373786 Ni 5.27246310 7.03505815 8.82528677 -0.14970340 0.12173085 -0.10717210 Ni 3.52824690 8.82943222 8.78054345 0.07681959 -0.40386658 -0.40997375 Cu 7.05985942 7.03042250 7.04846330 -0.31454889 -0.23261361 -0.17133620 Ni 8.76633443 8.80092468 7.04088823 -0.19548691 -0.29368749 -0.27009896 Ni 8.81742262 7.05115398 8.81023306 -0.23781047 -0.16641952 -0.38416223 Ni 7.04753040 8.76365195 8.79589799 -0.31092731 -0.21893562 -0.21862272