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=34.560176865478525 stress="-5.049625485884017 0.5600683104481812 -0.2585814526389635 0.5600683104481812 -4.626560792501305 -0.3265380840014087 -0.2585814526389635 -0.3265380840014087 -7.373386868650295" free_energy=34.560176865478525 pbc="F F T" Ta 0.26235339 0.21005355 0.21211731 -37.86840326 -59.35623514 -34.31028590 Ta 1.44968690 1.79594673 0.21042663 29.14535344 41.57221802 -10.50965675 Ta 1.49042854 0.24122900 1.52201293 71.64153294 -41.88559086 20.22403040 Ta 0.04376171 1.22051529 1.57710464 -62.91848312 59.66960797 24.59591226