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=17761.464211256767 stress="-3644.8665984922723 346.623415821921 -97.92103298810743 346.623415821921 -2971.513782322693 112.84108972075964 -97.92103298810743 112.84108972075964 -1478.0425421658408" pbc="T T T" Pu 0.34217151 -0.14593172 -0.06275233 -23940.30054191 19103.65757327 -3211.02400310 Pu 1.56550738 1.62854119 -0.00302221 23741.25014033 -17250.79398090 -4630.34687131 Pu 1.74444965 0.24857179 1.37031721 -11829.47620937 -24733.58039987 4441.52578245 Pu 0.15722673 1.27723143 1.42171676 12028.52661095 22880.71680749 3399.84509196