{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.48715e-10 0.0 0.0 ] "source-value" [ 5.48715 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] "source-value" [ 0.0853536 5.45185 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] "source-value" [ -0.0925937 0.0373061 5.50955 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.723634566118548e-09 1.034307548030131e-10 6.355410077909088e-10 ] [ 1.618405868880393e-09 -1.386820050315168e-09 -1.397244131845417e-09 ] [ -3.217446228945178e-10 -2.20653686828521e-10 4.039767865665317e-09 ] [ -2.616831870399398e-09 -2.796167505007094e-09 3.343475204331589e-09 ] [ 2.488233804801535e-09 3.9343496107642e-09 -4.412979208149792e-10 ] [ -1.605318328935727e-09 6.632075538965454e-10 -2.966840170626124e-10 ] [ 1.047322990026862e-09 -5.918632698429696e-10 -3.032648614019513e-09 ] [ 2.1135667246394e-09 2.945165925299943e-10 -2.850909394045292e-09 ] ] "source-value" [ [ -1.699959 0.0645564 0.3966735 ] [ 1.0101295 -0.865585 -0.8720912 ] [ -0.2008172 -0.1377212 2.5214248 ] [ -1.633298 -1.7452305 2.0868331 ] [ 1.5530334 2.4556279 -0.2754365 ] [ -1.0019609 0.4139416 -0.1851756 ] [ 0.6536876 -0.369412 -1.8928304 ] [ 1.3191846 0.1838228 -1.7793977 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.08625e-11 -3.46204e-12 -9.3953e-12 ] [ 1.31877e-10 1.39109e-10 1.34024e-10 ] [ -1.98257e-12 2.75858e-10 2.57664e-10 ] [ 1.43337e-10 4.133e-10 3.94558e-10 ] [ 2.6449e-10 -4.467320000000001e-12 2.70542e-10 ] [ 4.12571e-10 1.36749e-10 4.0773e-10 ] [ 2.7517e-10 2.72879e-10 3.16261e-12 ] [ 4.07324e-10 4.11206e-10 1.36119e-10 ] ] "source-value" [ [ 0.108625 -0.0346204 -0.093953 ] [ 1.31877 1.39109 1.34024 ] [ -0.0198257 2.75858 2.57664 ] [ 1.43337 4.133 3.94558 ] [ 2.6449 -0.0446732 2.70542 ] [ 4.12571 1.36749 4.0773 ] [ 2.7517 2.72879 0.0316261 ] [ 4.07324 4.11206 1.36119 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.414280796267809e-18 "source-value" -33.793283 } }