{ "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" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6902464 0.2436669 -0.3405621 ] [ 0.9467128 1.7257733 1.2460201 ] [ 1.602797 -1.0800539 0.1671654 ] [ -0.3943669 0.1922479 -2.8459437 ] [ -0.366581 -0.4076079 -0.7629302 ] [ 1.8146209 0.0862019 -1.7314868 ] [ -0.1709849 -0.8756004 2.8863817 ] [ -0.7419516 0.1153721 1.3813556 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.310249886271365e-09 3.903974104428115e-10 -5.456406345505516e-10 ] [ 1.516801114772106e-09 2.764993634060865e-09 1.996344273266878e-09 ] [ 2.567963881288378e-09 -1.730437107783861e-09 2.678284956866803e-10 ] [ -6.318454271973716e-10 3.080150907778963e-10 -4.559704460253049e-09 ] [ -5.873275078294847e-10 -6.530598478333844e-10 -1.222348929742268e-09 ] [ 2.907343181595055e-09 1.381106688485395e-10 -2.774147670183805e-09 ] [ -2.739480092898259e-10 -1.402866490043128e-09 4.624493278444959e-09 ] [ -1.188737507285153e-09 1.848464813125997e-10 2.213175647331157e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.738582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.886169716174371e-18 } }