{ "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" [ [ 3.5590258 -5.976845 2.1206643 ] [ 1.0700921 0.9917208 3.2637561 ] [ 1.4043217 1.503022 -0.7260987 ] [ -1.5978697 0.1165169 -1.4105536 ] [ 0.1072462 0.3196442 -1.6093682 ] [ -6.3392355 5.7390267 -5.2360725 ] [ 2.9430948 -1.2045895 0.7594805 ] [ -1.1466753 -1.4884961 2.8381921 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.702187976563157e-09 -9.575961404039729e-09 3.397678790017966e-09 ] [ 1.714476558847991e-09 1.588911893211787e-09 5.229113762494967e-09 ] [ 2.249971414359158e-09 2.408106728787948e-09 -1.163338371117776e-09 ] [ -2.560069497516589e-09 1.866806546461146e-10 -2.259956018924582e-09 ] [ 1.718273557252908e-10 5.121264684336227e-10 -2.578492125542638e-09 ] [ -1.01565749955233e-08 9.194934480642129e-09 -8.389113013429963e-09 ] [ 4.715357720206903e-09 -1.929965150461743e-09 1.216821911078637e-09 ] [ -1.83717637244494e-09 -2.384833671220127e-09 4.547285065423391e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.562471 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.415994701150261e-18 } }