{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1743545 -3.7097493 -5.2931419 ] [ -2.1196082 6.2520008 -3.1641941 ] [ -3.3970183 1.9743384 6.6550305 ] [ 2.291868 -6.875801 2.7276978 ] [ 7.399113 2.3592111 -0.9253923 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.688053186831274e-09 -5.943673597489165e-09 -8.480548202756892e-09 ] [ -3.395986703295971e-09 1.00168095149829e-08 -5.069597810693298e-09 ] [ -5.44262330068976e-09 3.163238826027679e-09 1.066253427781093e-08 ] [ 3.671977327559655e-09 -1.101624761147326e-08 4.370253643767595e-09 ] [ 1.185468586325735e-08 3.779872867951851e-09 -1.48264190812834e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 31.183345 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.996122631734058e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1000839 1.3666156 -0.9083946 ] [ 0.8799934 8.6074735 0.0836817 ] [ 0.6571082 4.8913478 6.4474291 ] [ 4.2271067 -1.2705405 4.5720788 ] [ 7.0108648 4.9955895 1.924663 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.000839e-11 1.3666156e-10 -9.083946e-11 ] [ 8.799934000000001e-11 8.607473499999999e-10 8.36817e-12 ] [ 6.571082000000001e-11 4.8913478e-10 6.4474291e-10 ] [ 4.2271067e-10 -1.2705405e-10 4.5720788e-10 ] [ 7.0108648e-10 4.995589500000001e-10 1.924663e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.846037335159101e-34 } }