{ "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" [ [ 0.049795 0.7119441 0.3423404 ] [ 0.1447331 1.623908 1.772641 ] [ 2.54973 0.1092944 1.824085 ] [ 1.77811 2.382187 0.8238028 ] [ 2.019176 2.140924 2.983896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.9795e-12 7.119441e-11 3.423404e-11 ] [ 1.447331e-11 1.623908e-10 1.772641e-10 ] [ 2.54973e-10 1.092944e-11 1.824085e-10 ] [ 1.77811e-10 2.382187e-10 8.238028e-11 ] [ 2.019176e-10 2.140924e-10 2.983896e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0229961 -9.2419065 -11.9816858 ] [ -7.5069878 5.586011 12.9410102 ] [ 1.2779053 -1.8597535 0.0055055 ] [ 5.6783063 4.9682989 -5.5864093 ] [ 2.5737723 0.5473501 4.6215794 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.241197055389579e-09 -1.480716652591956e-08 -1.919677686653135e-08 ] [ -1.202752034579083e-08 8.94977622773163e-09 2.073378399197433e-08 ] [ 2.04742999525641e-09 -2.979653578150973e-09 8.8207833858144e-12 ] [ 9.097649599601351e-09 7.960092342726356e-09 -8.950414374679694e-09 ] [ 4.123637806322644e-09 8.76951533612542e-10 7.404586465850891e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.1636538 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.46655553386508e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5868979 0.7124928 0.3478156 ] [ -0.2452896 1.6315811 2.34726 ] [ 2.2282862 -0.0826906 1.8339399 ] [ 1.9419298 2.6320639 0.4668592 ] [ 2.0297198 2.0748102 2.7508905 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.868979e-11 7.124928000000001e-11 3.478156e-11 ] [ -2.452896e-11 1.6315811e-10 2.34726e-10 ] [ 2.2282862e-10 -8.269060000000001e-12 1.8339399e-10 ] [ 1.9419298e-10 2.6320639e-10 4.668592e-11 ] [ 2.0297198e-10 2.0748102e-10 2.7508905e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 -3.8e-06 -4.6e-06 ] [ -3.5e-06 6e-07 1.8e-06 ] [ 1.8e-06 -4e-06 0.0 ] [ 2.1e-06 3.6e-06 -1.7e-06 ] [ 2.8e-06 3.7e-06 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.126965186560001e-15 -6.08827115904e-15 -7.370012455680001e-15 ] [ -5.6076181728e-15 9.6130597248e-16 2.88391791744e-15 ] [ 2.88391791744e-15 -6.4087064832e-15 0.0 ] [ 3.36457090368e-15 5.76783583488e-15 -2.72370025536e-15 ] [ 4.48609453824e-15 5.928053496960001e-15 7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }