{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0492615 -2.3946769 -3.4006599 ] [ -0.3849383 -0.2278595 3.0963128 ] [ 0.1052726 1.4605886 -0.4001721 ] [ -1.1725035 1.5569789 -0.0359188 ] [ 1.4029077 -0.3950313 0.740438 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.89256236055392e-11 -3.83669534354982e-09 -5.448457787072067e-09 ] [ -6.167391447104966e-10 -3.650711637271776e-10 4.960839978843786e-09 ] [ 1.686652985308301e-10 2.340120907527003e-09 -6.411463829164397e-10 ] [ -1.878557695506173e-09 2.494555192658901e-09 -5.754826160719104e-11 ] [ 2.2477059180803e-09 -6.32909913344231e-10 1.186312452751911e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.714537 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.037093392569657e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1515437 1.8809743 2.4180298 ] [ 1.6743306 2.0417596 4.7759355 ] [ 2.426693 4.24607 2.0386639 ] [ 4.4967072 1.372988 2.6535313 ] [ 3.5802735 3.2262391 3.8940634 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1515437e-10 1.8809743e-10 2.4180298e-10 ] [ 1.6743306e-10 2.0417596e-10 4.7759355e-10 ] [ 2.426693e-10 4.24607e-10 2.0386639e-10 ] [ 4.496707200000001e-10 1.372988e-10 2.6535313e-10 ] [ 3.5802735e-10 3.2262391e-10 3.8940634e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.5e-06 -1.01e-05 -1.14e-05 ] [ -1.9e-06 2.1e-06 5.4e-06 ] [ -2.1e-06 8.8e-06 3.4e-06 ] [ 8.7e-06 -3.6e-06 4e-06 ] [ 4.9e-06 2.8e-06 -1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.52206778976e-14 -1.618198387008e-14 -1.826481347712e-14 ] [ -3.04413557952e-15 3.36457090368e-15 8.65175375232e-15 ] [ -3.36457090368e-15 1.409915426304e-14 5.44740051072e-15 ] [ 1.393893660096e-14 -5.76783583488e-15 6.4087064832e-15 ] [ 7.850665441919999e-15 4.48609453824e-15 -2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.621881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.182465926951973e-18 } }