{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.1768239 -6.2514543 14.9870421 ] [ -11.6910607 5.3959363 6.8175806 ] [ 14.1275709 -32.6183802 7.6292571 ] [ 105.0815644 16.9194374 30.8232039 ] [ -97.3412507 16.5544608 -60.2570835 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.630506932657868e-08 -1.001593392545963e-08 2.401188846756534e-08 ] [ -1.873114412589368e-08 8.645242987186054e-09 1.092296824773964e-08 ] [ 2.263486380467441e-08 -5.226040616480563e-08 1.222341735969241e-08 ] [ 1.683592257587696e-07 2.710792703936914e-08 4.938421666673138e-08 ] [ -1.559578761109716e-07 2.652317006371007e-08 -9.654249042129344e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 31.300791 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.014939555274706e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0347915 0.3341281 3.1012423 ] [ -0.1670738 2.0117091 1.973198 ] [ 3.1430268 0.1373258 2.0775965 ] [ 3.2440471 1.6931345 0.3167744 ] [ 1.1984314 2.8518243 0.2524882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0347915e-10 3.341281e-11 3.1012423e-10 ] [ -1.670738e-11 2.0117091e-10 1.973198e-10 ] [ 3.1430268e-10 1.373258e-11 2.0775965e-10 ] [ 3.2440471e-10 1.6931345e-10 3.167744e-11 ] [ 1.1984314e-10 2.8518243e-10 2.524882e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-06 3.8e-06 6e-07 ] [ 7.2e-06 1.4e-06 7e-06 ] [ 1e-07 -5.4e-06 -8.2e-06 ] [ 8.5e-06 7e-06 9.2e-06 ] [ -8.9e-06 -6.9e-06 -8.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-14 6.08827115904e-15 9.6130597248e-16 ] [ 1.153567166976e-14 2.24304726912e-15 1.12152363456e-14 ] [ 1.6021766208e-16 -8.65175375232e-15 -1.313784829056e-14 ] [ 1.36185012768e-14 1.12152363456e-14 1.474002491136e-14 ] [ -1.425937192512e-14 -1.105501868352e-14 -1.393893660096e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.57084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853852933101747e-18 } }