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=5.295364103643692 stress="-2.025376683383004 -0.06368153245541032 -0.13074942079759203 -0.06368153245541032 -2.043421285013026 0.0806779304193906 -0.13074942079759203 0.0806779304193906 -1.0907793356164646" free_energy=5.295364103643692 pbc="T T F" Ga 0.35559622 0.06504129 0.22277084 -2.07483748 2.17333519 -9.33139155 Ga 1.68584377 1.68362810 0.19581920 -1.08599401 -0.81997272 -12.11043073 Ga 1.64685009 0.30807721 1.67626233 -2.77472538 -2.61999876 10.36170704 Ga 2.85402479 1.66771000 1.49207130 5.93555687 1.26663629 11.08011524