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=81.45678808390666 stress="-10.429835925547508 1.6353323500453134 0.48052372515995073 1.6353323500453134 -11.878217205139265 0.6408207410038395 0.48052372515995073 0.6408207410038395 -11.148778153999103" free_energy=81.45678808390666 pbc="T T T" Si 0.05280714 2.72759613 2.84655491 1.61174996 -16.41979715 -37.75138827 Si 1.37241235 1.32230844 2.91049160 17.81273646 -10.62032639 -6.58692168 Si 1.21130485 2.93858073 1.25205420 1.40709579 43.28129475 10.28161513 Si 0.15488783 1.55988540 1.20245745 -20.83158221 -16.24117121 34.05669481