{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0587563 2.624587 0.4359975 ] [ 0.6130103 1.606213 2.369845 ] [ 2.872214 1.39186 0.7464612 ] [ 1.941337 0.0175427 2.118778 ] [ 2.055015 2.698548 0.547582 ] [ 2.796139 2.772611 2.055467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.87563e-12 2.624587e-10 4.359975e-11 ] [ 6.130103e-11 1.606213e-10 2.369845e-10 ] [ 2.872214e-10 1.39186e-10 7.464612e-11 ] [ 1.941337e-10 1.75427e-12 2.118778e-10 ] [ 2.055015e-10 2.698548e-10 5.47582e-11 ] [ 2.796139e-10 2.772611e-10 2.055467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.5218286 2.4329615 -5.74894 ] [ -19.5127949 -2.1827993 16.2022292 ] [ 35.2512256 -43.3902733 -14.1733345 ] [ -0.7372704 -18.4355987 5.6187552 ] [ -17.3130406 41.2476181 -37.338791 ] [ 19.8337088 20.3280917 35.440081 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.807306413658479e-08 3.898034034606499e-09 -9.210817262381952e-09 ] [ -3.126294379524547e-08 -3.497230006358606e-09 2.595883282908309e-08 ] [ 5.647868951086645e-08 -6.951888145138246e-08 -2.270818517467806e-08 ] [ -1.181237398087864e-09 -2.953708522759087e-08 9.002238219438428e-09 ] [ -2.773854888428121e-08 6.608596938350692e-08 -5.982333798913745e-08 ] [ 3.177710454311522e-08 3.256919326721853e-08 5.678126921745828e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.072237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.215926884855674e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1657286 2.5897943 0.6176614 ] [ 0.6359732 1.714303 2.6837048 ] [ 3.3846695 1.0546458 0.7671174 ] [ 1.7431992 -0.2480548 1.9084973 ] [ 2.0576278 3.0275197 -0.1302039 ] [ 2.6807305 2.9731536 2.4273537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.657286e-11 2.5897943e-10 6.176614e-11 ] [ 6.359732000000001e-11 1.714303e-10 2.6837048e-10 ] [ 3.3846695e-10 1.0546458e-10 7.671174e-11 ] [ 1.7431992e-10 -2.480548e-11 1.9084973e-10 ] [ 2.0576278e-10 3.0275197e-10 -1.302039e-11 ] [ 2.6807305e-10 2.9731536e-10 2.4273537e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-05 3.23e-05 -2.31e-05 ] [ 9.6e-06 -2.03e-05 2.27e-05 ] [ 2.7e-05 2.16e-05 1.53e-05 ] [ -3e-06 1.48e-05 1.7e-05 ] [ -1.63e-05 -7e-07 -2.79e-05 ] [ -3e-07 -4.77e-05 -4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72370025536e-14 5.175030485184e-14 -3.701027994048e-14 ] [ 1.538089555968e-14 -3.252418540224e-14 3.636940929216e-14 ] [ 4.32587687616e-14 3.460701500928e-14 2.451330229824e-14 ] [ -4.8065298624e-15 2.371221398784e-14 2.72370025536e-14 ] [ -2.611547891904e-14 -1.12152363456e-15 -4.470072772032e-14 ] [ -4.8065298624e-16 -7.642382481215999e-14 -6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.124626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423232217554382e-18 } }