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=10.718003035356777 stress="-1.965054817523921 -0.21234632844064955 -0.35563719235552077 -0.21234632844064955 -1.1883799277375615 0.020746073079921636 -0.35563719235552077 0.020746073079921636 -1.521924682867884" free_energy=10.718003035356777 pbc="T F F" Ni 2.94630638 0.03851086 0.14982991 -7.83726128 -11.86467910 -10.95837386 Ti 1.24795387 1.32929456 0.28095696 -0.30680992 12.61719314 -27.15177429 Ni 1.25663482 0.26008946 1.37675974 5.30722335 -11.22594744 21.02767605 Ti 2.64973583 1.78460712 1.25346517 2.83684785 10.47343341 17.08247209