{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2134684 0.3942551 0.0730179 ] [ -9.62224 -7.8010645 5.6471195 ] [ 0.4974925 -1.4859056 -2.6477535 ] [ 0.5456177 2.7913764 2.1560439 ] [ 1.3877834 -2.4131484 3.4445864 ] [ -0.6613997 -1.3867835 1.4062185 ] [ 4.9884322 6.338878 -10.3398212 ] [ 1.6508455 3.5623925 0.2605885 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.944190716577365e-09 6.316663090553333e-10 1.169875732437486e-10 ] [ -1.541652809474016e-08 -1.249868326222689e-08 9.047682912305762e-09 ] [ 7.970708590902449e-10 -2.38068323264975e-09 -4.242168790291719e-09 ] [ 8.741759300368217e-10 4.472278044779037e-09 3.454363158458232e-09 ] [ 2.223474136533075e-09 -3.866289980854485e-09 5.518835843874177e-09 ] [ -1.05967914507461e-09 -2.221872120116739e-09 2.253010422998529e-09 ] [ 7.992349511133214e-09 1.015600221737665e-08 -1.656621992637784e-08 ] [ 2.644946086444047e-09 5.707582024636845e-09 4.17508805789109e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -30.801719 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.934979446883384e-18 } }