{ "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" [ [ 2.053874 2.225583 2.945298 ] [ 1.808711 4.658327 2.287931 ] [ 4.038397 2.121863 2.154331 ] [ 3.514533 3.432892 3.895035 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.053874e-10 2.225583e-10 2.945298000000001e-10 ] [ 1.808711e-10 4.658327e-10 2.287931e-10 ] [ 4.038397e-10 2.121863e-10 2.154331e-10 ] [ 3.514533e-10 3.432892e-10 3.895035e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9874331 -1.0058963 -0.4917586 ] [ 0.6042548 -1.0658399 0.6058764 ] [ 3.0323828 -0.9565431 -2.2861006 ] [ 1.3507955 3.0282793 2.1719829 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.990748710624067e-09 -1.611623534809223e-09 -7.878841319973389e-10 ] [ 9.681229135661798e-10 -1.70766376929581e-09 9.70721003174469e-10 ] [ 4.858412827476042e-09 -1.532550991607557e-09 -3.662736934116853e-09 ] [ 2.164212969581847e-09 4.851838295712589e-09 3.479900223157385e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.822118620327119 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.521532474612463e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8069097 2.1287523 3.0861088 ] [ 2.2729095 4.2750988 2.1625862 ] [ 3.8673617 2.5169205 1.9544487 ] [ 3.4683342 3.5178934 4.0794513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8069097e-10 2.1287523e-10 3.0861088e-10 ] [ 2.2729095e-10 4.2750988e-10 2.1625862e-10 ] [ 3.8673617e-10 2.5169205e-10 1.9544487e-10 ] [ 3.4683342e-10 3.5178934e-10 4.0794513e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.37e-05 2.89e-05 -3e-05 ] [ -3.89e-05 -2.86e-05 -6e-06 ] [ 2.07e-05 -8.4e-06 -6.9e-06 ] [ 4.2e-05 8.1e-06 4.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.797158591296e-14 4.630290434112001e-14 -4.8065298624e-14 ] [ -6.232467054911999e-14 -4.582225135488e-14 -9.6130597248e-15 ] [ 3.316505605055999e-14 -1.345828361472e-14 -1.105501868352e-14 ] [ 6.72914180736e-14 1.297763062848e-14 6.873337703232e-14 ] ] } "relaxed-potential-energy" { "source-value" -4.0298336203271194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.456505212201934e-19 } }