{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7219469 -4.6675122 -9.173161 ] [ -0.390466 -0.2875486 0.7586757 ] [ -9.2974784 -7.7974523 1.6149053 ] [ -3.7426973 2.4230048 -1.1387124 ] [ 9.8414798 -5.2442172 5.3951448 ] [ 3.4206901 6.6429271 -2.9941941 ] [ 3.8904187 8.9307983 5.5373418 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.963216307039035e-09 -7.478178924138775e-09 -1.469702409303435e-08 ] [ -6.255954964172928e-10 -4.607036442637709e-10 1.215532469309075e-09 ] [ -1.489620252487299e-08 -1.249289577686319e-08 2.58736351646601e-09 ] [ -5.996462112791284e-09 3.88208164264618e-09 -1.824418385095058e-09 ] [ 1.576778884963546e-08 -8.402162192237238e-09 8.643974864390692e-09 ] [ 5.480549705222014e-09 1.064314249329874e-08 -4.797227785157297e-09 ] [ 6.233137886263129e-09 1.430871624134038e-08 8.871799573338591e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.503943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.682917190081582e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8994663 1.4227513 1.1303531 ] [ 1.6297589 2.658792 5.4268169 ] [ 1.460644 1.3295031 3.2169942 ] [ 0.7232538 3.7906555 3.3079812 ] [ 4.0253972 1.6299253 3.4702505 ] [ 4.2330343 3.50138 1.6701584 ] [ 3.2058705 4.0497038 3.9234337 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8994663e-10 1.4227513e-10 1.1303531e-10 ] [ 1.6297589e-10 2.658792e-10 5.4268169e-10 ] [ 1.460644e-10 1.3295031e-10 3.2169942e-10 ] [ 7.232537999999999e-11 3.7906555e-10 3.3079812e-10 ] [ 4.0253972e-10 1.6299253e-10 3.4702505e-10 ] [ 4.2330343e-10 3.50138e-10 1.6701584e-10 ] [ 3.2058705e-10 4.0497038e-10 3.9234337e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-06 1.4e-06 -1.75e-05 ] [ -7.1e-06 4.6e-06 -1e-07 ] [ 3.1e-06 1.6e-06 1.49e-05 ] [ -3.4e-06 -1.7e-05 7.6e-06 ] [ -1.69e-05 1.24e-05 -7.1e-06 ] [ 2.43e-05 -8.2e-06 -8.4e-06 ] [ 1.4e-06 5.2e-06 1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.24304726912e-15 2.24304726912e-15 -2.8038090864e-14 ] [ -1.137545400768e-14 7.370012455680001e-15 -1.6021766208e-16 ] [ 4.96674752448e-15 2.56348259328e-15 2.387243164992e-14 ] [ -5.44740051072e-15 -2.72370025536e-14 1.217654231808e-14 ] [ -2.707678489152e-14 1.986699009792e-14 -1.137545400768e-14 ] [ 3.893289188544e-14 -1.313784829056e-14 -1.345828361472e-14 ] [ 2.24304726912e-15 8.33131842816e-15 1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.094034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.578548500916031e-18 } }