{ "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" [ 5.47042 0 0 ] "si-unit" "m" "si-value" [ 5.47042e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0146058 5.3888 0 ] "si-unit" "m" "si-value" [ 1.46058e-12 5.3888e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.134413 -0.103851 5.39218 ] "si-unit" "m" "si-value" [ 1.34413e-11 -1.03851e-11 5.39218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0813222 0.0658783 -0.0148119 ] [ 1.29496 1.3028 1.25678 ] [ 0.00731236 2.63688 2.91411 ] [ 1.38293 3.97853 4.11798 ] [ 2.91023 -0.000259257 2.64672 ] [ 4.15592 1.24599 4.16086 ] [ 2.63613 2.74458 -0.00927687 ] [ 4.0418 4.10114 1.35651 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.13222e-12 6.58783e-12 -1.48119e-12 ] [ 1.29496e-10 1.3028e-10 1.25678e-10 ] [ 7.31236e-13 2.63688e-10 2.91411e-10 ] [ 1.38293e-10 3.97853e-10 4.11798e-10 ] [ 2.91023e-10 -2.59257e-14 2.64672e-10 ] [ 4.15592e-10 1.24599e-10 4.16086e-10 ] [ 2.63613e-10 2.74458e-10 -9.27687e-13 ] [ 4.0418e-10 4.10114e-10 1.35651e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1933056 -1.0793206 0.7745355 ] [ 0.9112402 0.890176 2.3469595 ] [ -0.1646265 0.1649274 -2.8434839 ] [ 1.3157182 0.7377159 -1.0273175 ] [ -3.2628127 0.8113947 1.4326708 ] [ -0.6436384 0.5445611 -0.9206656 ] [ 0.3082232 0.0830722 0.8308656 ] [ 1.7292016 -2.1525268 -0.5935644 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.097097155413504e-10 -1.72926224591486e-09 1.240942680303507e-09 ] [ 1.459967756401487e-09 1.426219187347584e-09 3.760243671844322e-09 ] [ -2.63760731637201e-10 2.642428265863716e-10 -4.555763463735192e-09 ] [ 2.108012956968539e-09 1.181951177510281e-09 -1.645944094199295e-09 ] [ -5.227602269058452e-09 1.29999762929144e-09 2.295391679974087e-09 ] [ -1.031222405225145e-09 8.724830702053373e-10 -1.47506891204759e-09 ] [ 4.938280090967087e-10 1.330963377749748e-10 1.33119345031439e-09 ] [ 2.770486398995414e-09 -3.448728143018791e-09 -9.509950124542294e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.871204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.747200488224733e-18 } }