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=19.730845505558634 stress="-2.607137925730575 0.6028514082506959 -0.018317648445594473 0.6028514082506959 -2.1327081966780512 0.028772654961113125 -0.018317648445594473 0.028772654961113125 -1.598889077082131" free_energy=19.730845505558634 pbc="T F F" Li 0.03273964 0.07675992 0.29497883 -9.21058061 -8.60508511 -15.66540441 Li 1.06279902 1.31113270 0.29119256 7.70068944 11.04151876 -20.89166692 Si 1.21611711 0.16188986 1.44564997 20.98814125 -35.63395995 20.09471252 Si -0.05943754 1.49214527 1.50795817 -19.47825008 33.19752629 16.46235882