{ "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" [ [ 2.000595 3.042383 1.797674 ] [ 1.826337 5.433854 1.209578 ] [ 3.662908 4.706413 0.0276768 ] [ 4.382961 3.15094 1.702274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.000595e-10 3.042383e-10 1.797674e-10 ] [ 1.826337e-10 5.433854e-10 1.209578e-10 ] [ 3.662908e-10 4.706413e-10 2.76768e-12 ] [ 4.382961e-10 3.15094e-10 1.702274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1303612 0.3914344 0.1882608 ] [ -0.5036615 -0.3239825 0.2170613 ] [ 0.6777399 -0.0316373 -0.1447455 ] [ -0.0437172 -0.0358146 -0.2605766 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.08861666899433e-10 6.271470442568755e-10 3.016270523731046e-10 ] [ -8.069546800970593e-10 -5.19077187048336e-10 3.477705401404551e-10 ] [ 1.08585902276333e-09 -5.068854240523584e-11 -2.319078560660064e-10 ] [ -7.004267576683776e-11 -5.738131480330368e-11 -4.174897364475533e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.1583098 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.146887660600352e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0081243 3.1836653 2.1945276 ] [ 1.7269543 5.1618813 0.9651986 ] [ 3.9282791 4.9831342 0.1740802 ] [ 4.2094433 3.0049093 1.4033965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0081243e-10 3.1836653e-10 2.1945276e-10 ] [ 1.7269543e-10 5.1618813e-10 9.651986e-11 ] [ 3.9282791e-10 4.9831342e-10 1.740802e-11 ] [ 4.209443300000001e-10 3.0049093e-10 1.4033965e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -2.1e-06 -4.8e-06 ] [ 9.6e-06 4e-07 5e-07 ] [ -8.7e-06 -2.2e-06 4e-07 ] [ -4.5e-06 3.9e-06 3.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.76783583488e-15 -3.36457090368e-15 -7.69044777984e-15 ] [ 1.538089555968e-14 6.408706483200001e-16 8.010883104e-16 ] [ -1.393893660096e-14 -3.52478856576e-15 6.408706483200001e-16 ] [ -7.2097947936e-15 6.24848882112e-15 6.24848882112e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.4643956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.195928011872239e-18 } }