{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.39143 0 0 ] "si-unit" "m" "si-value" [ 5.39143e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.144963 5.17841 0 ] "si-unit" "m" "si-value" [ 1.44963e-11 5.178410000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.144779 0.421312 5.38784 ] "si-unit" "m" "si-value" [ -1.44779e-11 4.21312e-11 5.38784e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.15223 0.0692904 -0.00428898 ] [ 1.42734 1.24068 1.17973 ] [ -0.332931 2.76994 2.80275 ] [ 1.2591 4.25807 3.96691 ] [ 2.6931 0.104845 2.7319 ] [ 4.09744 1.52781 4.38962 ] [ 2.50984 2.47613 -0.202936 ] [ 4.16866 4.11218 1.07304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5223e-11 6.929040000000001e-12 -4.288980000000001e-13 ] [ 1.42734e-10 1.24068e-10 1.17973e-10 ] [ -3.32931e-11 2.76994e-10 2.80275e-10 ] [ 1.2591e-10 4.25807e-10 3.96691e-10 ] [ 2.6931e-10 1.04845e-11 2.7319e-10 ] [ 4.09744e-10 1.52781e-10 4.38962e-10 ] [ 2.50984e-10 2.47613e-10 -2.02936e-11 ] [ 4.16866e-10 4.11218e-10 1.07304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.8397073 -7.0898569 2.340661 ] [ -1.0512826 2.6779103 5.16213 ] [ 3.5255777 0.5628594 -1.9654586 ] [ -2.825577 0.0817911 -1.9647499 ] [ 1.7699554 1.0666014 -0.4102983 ] [ -8.9128764 5.80129 -7.4071083 ] [ 5.017971 0.2125993 1.5414086 ] [ -3.3634754 -3.3131947 2.7034155 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.356242508375092e-09 -1.135920296999756e-08 3.750152331418349e-09 ] [ -1.684340403573838e-09 4.290485275259515e-09 8.270643999530304e-09 ] [ 5.648598165753837e-09 9.018001714775156e-10 -3.149011818070299e-09 ] [ -4.527073409670202e-09 1.310437882095149e-10 -3.147876355499138e-09 ] [ 2.835781161738712e-09 1.708883826792549e-09 -6.573703438139847e-10 ] [ -1.428000219216007e-08 9.294691208480832e-09 -1.186749574599363e-08 ] [ 8.039675820052397e-09 3.406216280584454e-10 2.469608822020059e-09 ] [ -5.388881650515929e-09 -5.30832308849847e-09 4.331349110408343e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.296737 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.014290032872633e-18 } }