{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6136317 0.272403 0.5113261 ] [ 1.058649 2.716721 0.3297698 ] [ 0.0311528 1.744123 2.343307 ] [ 2.175185 1.227279 1.696033 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.136317e-11 2.72403e-11 5.113261e-11 ] [ 1.058649e-10 2.716721e-10 3.297698e-11 ] [ 3.11528e-12 1.744123e-10 2.343307e-10 ] [ 2.175185e-10 1.227279e-10 1.696033e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3335913 -4.6193569 -3.9695093 ] [ -0.5915991 3.7528914 -2.9295606 ] [ -3.9253731 1.2825952 3.3827587 ] [ 7.8505634 -0.4161298 3.5163112 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.341002088165684e-09 -7.401025689286673e-09 -6.359855048905695e-09 ] [ -9.478462547154293e-10 6.012794911019548e-09 -4.69367354120702e-09 ] [ -6.289141060552144e-09 2.054944060320557e-09 5.419776947600215e-09 ] [ 1.257798924321559e-08 -6.667134422710931e-10 5.6337516425125e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1399889 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.235170114599361e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4944185 0.2004807 0.3886033 ] [ 1.0187419 2.7668127 0.2463916 ] [ -0.0665787 1.7680944 2.4156871 ] [ 2.4320369 1.2251382 1.8297539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.944185e-11 2.004807e-11 3.886033e-11 ] [ 1.0187419e-10 2.7668127e-10 2.463916e-11 ] [ -6.657870000000001e-12 1.7680944e-10 2.4156871e-10 ] [ 2.4320369e-10 1.2251382e-10 1.8297539e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-06 -8e-07 2e-07 ] [ -7e-07 1.1e-06 1e-07 ] [ -8e-07 1.2e-06 3e-07 ] [ 1e-07 -1.5e-06 -6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.2430472876e-15 -1.2817413072e-15 3.204353268e-16 ] [ -1.1215236438e-15 1.7623942974e-15 1.602176634e-16 ] [ -1.2817413072e-15 1.9226119608e-15 4.806529901999999e-16 ] [ 1.602176634e-16 -2.403264951e-15 -9.613059803999998e-16 ] ] } "relaxed-potential-energy" { "source-value" -7.091081 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.136116428800135e-18 } }