{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1960555 1.9576034 -9.5170924 ] [ 1.0062521 0.5183184 -4.165062 ] [ 1.1084887 7.1394133 2.1812884 ] [ 0.022698 -2.7931334 1.2540663 ] [ 0.1780917 -2.2854192 5.6064252 ] [ -3.2040269 -1.4204031 8.843533 ] [ -0.4813613 -0.2021811 -7.352358 ] [ 1.1738021 -2.9141982 3.1491995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.141155384792544e-10 3.136426400278591e-09 -1.524806294127336e-08 ] [ 1.612193589250904e-09 8.304376226104627e-10 -6.67316496058249e-09 ] [ 1.775994679560985e-09 1.143860107548858e-08 3.494809277702239e-09 ] [ 3.63662049389184e-11 -4.475093032255615e-09 2.009235706793159e-09 ] [ 2.853343580985274e-10 -3.66164521096744e-09 8.982483381703963e-09 ] [ -5.1334169915943e-09 -2.275736638931844e-09 1.416890181787329e-08 ] [ -7.712258210178951e-10 -3.239298315876269e-10 -1.177977609535185e-08 ] [ 1.880638282065944e-09 -4.669060224417442e-09 5.04557381313505e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -200.24375 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.2082585471132e-17 } }