500 Lattice="7.654792599029559 0.0 0.0 0.0 7.654792599029559 0.0 0.0 0.0 7.654792599029559" Properties=species:S:1:pos:R:3:forces:R:3 energy=-11524686.352259343 stress="-23660.163640544277 -75.00498670844816 -53.92771971017892 -75.00498670844816 -19112.976300639722 -415.6289311233962 -53.92771971017892 -415.6289311233962 -18465.24029974498" free_energy=-11524686.352259343 pbc="F F F" Cu 0.01495649 0.01300428 0.02367970 -180424.72028031 -183416.76034735 -182096.09134809 Cu 0.74305154 0.76521652 0.00267628 -404747.99975013 -375142.85527143 -970738.75055182 Cu 0.75455647 0.00881303 0.76747268 -380645.01764265 -973097.60958741 -350572.94103282 Cu 0.00988358 0.77402122 0.74376064 -953713.70188795 -351306.72304921 -374238.16730166 Cu 1.51513042 0.00928329 0.00854909 15128.14437649 -631697.94217290 -624791.94265505 Cu 2.30224797 0.75501823 0.00196068 -100290.43954631 -491873.06421118 -1841435.06804344 Cu 2.30355564 0.00295441 0.74550355 -121952.53213582 -1882982.66972819 -497904.63149582 Cu 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