{ "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" [ [ 2.2988432 -2.3893051 0.4972062 ] [ -2.1612782 2.3236728 3.852451 ] [ 3.817914 0.1381865 -2.0461457 ] [ -1.9277826 -0.5470192 -1.506406 ] [ 2.1924035 0.5364408 0.137986 ] [ -4.4154839 1.6282473 -4.3856791 ] [ 3.6380631 1.0948879 1.69331 ] [ -3.4426791 -2.7851112 1.7572776 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.683152860269788e-09 -3.828088802717033e-09 7.966121559199307e-10 ] [ -3.462749431613578e-09 3.722934265221355e-09 6.172306975829933e-09 ] [ 6.116972601421475e-09 2.21399181434241e-10 -3.278286830299573e-09 ] [ -3.088648237151768e-09 -8.764213805893727e-10 -2.413528494517404e-09 ] [ 3.512617659999819e-09 8.594729152842671e-10 2.21077945019124e-10 ] [ -7.074385132383192e-09 2.608739778433588e-09 -7.026632578242148e-09 ] [ 5.828819691837605e-09 1.754203810229328e-09 2.71298171611854e-09 ] [ -5.515780012380149e-09 -4.4622400877317e-09 2.815469110171599e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.800489292303475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.095000089389582e-18 } }