{ "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" [ [ 1.568329 2.374036 2.84115 ] [ 2.585215 4.223663 1.237778 ] [ 4.050363 2.582934 1.712612 ] [ 3.258528 3.911947 3.864299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.568329e-10 2.374036e-10 2.84115e-10 ] [ 2.585215e-10 4.223663e-10 1.237778e-10 ] [ 4.050363e-10 2.582934e-10 1.712612e-10 ] [ 3.258528e-10 3.911947e-10 3.864299e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.9825196 1.0672956 -1.4661931 ] [ -1.1045969 0.6268135 2.5097648 ] [ -1.2661064 -1.2913231 2.2550767 ] [ -0.6118163 -0.4027859 -3.2986483 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.778523213567026e-09 1.70999607189101e-09 -2.349100325752025e-09 ] [ -1.769759343168834e-09 1.004265943575759e-09 4.021086519395683e-09 ] [ -2.028526090237857e-09 -2.068927697764445e-09 3.613031196617827e-09 ] [ -9.80237780160334e-10 -6.453341574846605e-10 -5.285017230043821e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0344372 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.447476418318038e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6835625 2.3691313 2.6985838 ] [ 2.46844 4.3163239 1.3894988 ] [ 4.0148755 2.4467595 1.8738131 ] [ 3.295557 3.9603653 3.6939432 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6835625e-10 2.3691313e-10 2.6985838e-10 ] [ 2.46844e-10 4.3163239e-10 1.3894988e-10 ] [ 4.0148755e-10 2.4467595e-10 1.8738131e-10 ] [ 3.295557e-10 3.9603653e-10 3.6939432e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.4e-06 -2.3e-06 -8e-07 ] [ -1.1e-06 7e-07 -2e-06 ] [ 2.4e-06 -3e-07 -5e-07 ] [ 3.1e-06 2e-06 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.0495771896e-15 -3.685006258199999e-15 -1.2817413072e-15 ] [ -1.7623942974e-15 1.1215236438e-15 -3.204353268e-15 ] [ 3.845223921599999e-15 -4.806529901999999e-16 -8.010883169999999e-16 ] [ 4.9667475654e-15 3.204353268e-15 5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.7898544 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.568507596994209e-18 } }