4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=12.762568879085052 stress="-2.725071798550312 0.17503618152069553 0.535881096668927 0.17503618152069553 -2.684950793463928 0.4526224796152989 0.535881096668927 0.4526224796152989 -3.1750038889708994" free_energy=12.762568879085052 pbc="F F T" Si 0.29874826 0.05835534 -0.25354363 -24.21640475 -25.05087084 -0.29880737 Si 1.48193431 1.42001865 0.20070203 29.15753294 28.01421169 -19.04362945 Si 1.20342959 0.28187239 1.36500085 34.58612694 -34.90508142 10.77828031 Si 0.10170120 1.37793365 1.21904386 -39.52725513 31.94174057 8.56415651