{ "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" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0138347 4.8090016 3.437529 ] [ 0.4861439 -0.5727843 -0.3005772 ] [ -1.6868233 0.8248295 -1.3373719 ] [ 3.4040859 -4.7905073 -3.1398651 ] [ 0.2212127 1.1526581 -2.5630224 ] [ 1.2679986 -1.0400392 1.9545106 ] [ 0.0896894 1.1415704 1.4305343 ] [ 0.2315275 -1.5247288 0.5182628 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.430872116095782e-09 7.704869932909793e-09 5.507528597122004e-09 ] [ 7.788883909245332e-10 -9.177016142212934e-10 -4.815777625855257e-10 ] [ -2.702588854680704e-09 1.321522541046154e-09 -2.142705991494875e-09 ] [ 5.453946844174926e-09 -7.675238797831732e-09 -5.030618455685855e-09 ] [ 3.544218161640442e-10 1.846761859595749e-09 -4.106414567866706e-09 ] [ 2.031557712127131e-09 -1.666326490955536e-09 3.131471188425781e-09 ] [ 1.436982598135795e-10 1.828997405877304e-09 2.291968610712493e-09 ] [ 3.70947947572272e-10 -2.442884836420439e-09 8.303485415903463e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.569079 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.538577017638825e-18 } }