{ "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" [ 5.41643 0 0 ] "si-unit" "m" "si-value" [ 5.41643e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0584288 5.39313 0 ] "si-unit" "m" "si-value" [ 5.84288e-12 5.39313e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0447548 0.203328 5.3475 ] "si-unit" "m" "si-value" [ -4.47548e-12 2.03328e-11 5.3475e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0133581 0.0277146 -0.124532 ] [ 1.5025 1.22494 1.34546 ] [ 0.0458685 2.70233 2.56072 ] [ 1.46199 4.10879 4.17844 ] [ 2.74075 -0.0340431 2.6907 ] [ 4.13695 1.41216 4.09761 ] [ 2.75898 2.67415 0.0540851 ] [ 4.02257 4.13506 1.27654 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.33581e-12 2.77146e-12 -1.24532e-11 ] [ 1.5025e-10 1.22494e-10 1.34546e-10 ] [ 4.58685e-12 2.70233e-10 2.56072e-10 ] [ 1.46199e-10 4.10879e-10 4.17844e-10 ] [ 2.74075e-10 -3.40431e-12 2.6907e-10 ] [ 4.13695e-10 1.41216e-10 4.09761e-10 ] [ 2.75898e-10 2.67415e-10 5.40851e-12 ] [ 4.02257e-10 4.13506e-10 1.27654e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.6830688 -2.8322032 4.1054887 ] [ -2.257012 1.3722157 -0.8590929 ] [ 0.716063 0.580224 1.5507307 ] [ -2.6071591 0.5517015 -3.8894754 ] [ 0.6370017 0.5593929 2.3134253 ] [ -3.1765707 2.8318188 -3.730568 ] [ 1.9556823 -2.1959224 0.8008703 ] [ 2.0489259 -0.8672273 -0.2913788 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.298750103357911e-09 -4.537689752394946e-09 6.577718012098586e-09 ] [ -3.61613185926505e-09 2.198531913234706e-09 -1.376418559475272e-09 ] [ 1.14725939761991e-09 9.296213276270591e-10 2.484544472696818e-09 ] [ -4.177129356725969e-09 8.839232449602912e-10 -6.231626553056728e-09 ] [ 1.020589231149855e-09 8.962462262215123e-10 3.706515929627227e-09 ] [ -5.089427309858291e-09 4.537073875701911e-09 -5.977028831904614e-09 ] [ 3.133348458772372e-09 -3.518255530371026e-09 1.283135670953082e-09 ] [ 3.282741174731599e-09 -1.389451304979508e-09 -4.66840301156759e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -32.906959 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.272276037142415e-18 } }