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=14.720130621008712 stress="-3.061569567772199 -0.18677677014635 -0.0734426677495848 -0.18677677014635 -4.473542944964123 -0.12470866105971463 -0.0734426677495848 -0.12470866105971463 -4.216553174337107" free_energy=14.720130621008712 pbc="F T T" Ta 0.29417082 0.20408111 0.01855009 -30.23181361 -12.58668959 11.77165191 Cu 1.45887194 1.53691384 2.70677130 35.44567556 16.09227767 17.61537296 Cu 1.57736569 0.22577322 1.64977756 27.18384328 -9.70713519 -16.46304358 Ta 0.09364432 1.66157524 1.53273964 -32.39770522 6.20154711 -12.92398128