{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0204701 11.1042097 -1.4067447 ] [ -4.3971206 4.4499688 -11.9895472 ] [ -3.9746323 2.6400174 6.1184796 ] [ -1.1976775 1.5758195 -6.0692907 ] [ 10.5838308 -12.3869741 7.4425386 ] [ 3.8146755 -3.1562602 -2.4931823 ] [ 1.7236504 -3.4766403 5.2442792 ] [ -4.5322561 -0.7501408 3.1534676 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.237149983915643e-09 1.779090532037615e-08 -2.25385348834334e-09 ] [ -7.04496388220006e-09 7.129636033389018e-09 -1.920937237608012e-08 ] [ -6.368062999801678e-09 4.229774191633431e-09 9.802885050725666e-09 ] [ -1.918890905567535e-09 2.524741182301563e-09 -9.724075744493502e-09 ] [ 1.695716640596953e-08 -1.984612046898318e-08 1.192426144256307e-08 ] [ 6.111783952392266e-09 -5.056886343264167e-09 -3.994518425362377e-09 ] [ 2.761592396064753e-09 -5.570191853482749e-09 8.402261596412212e-09 ] [ -7.261474822723966e-09 -1.201858061970067e-09 5.052412104796058e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.462944 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.91939572756505e-18 } }