{ "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" [ [ 1.889016 4.339495 1.275975 ] [ 2.554838 3.101562 2.999193 ] [ 4.055705 3.657127 1.332404 ] [ 4.476672 4.505138 3.486766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.889016e-10 4.339495e-10 1.275975e-10 ] [ 2.554838e-10 3.101562e-10 2.999193e-10 ] [ 4.055705e-10 3.657127e-10 1.332404e-10 ] [ 4.476672e-10 4.505138e-10 3.486766e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8289916 0.6332657 -0.7974899 ] [ 0.242176 -0.3617132 1.2719818 ] [ 0.9146776 0.0825037 -0.2969595 ] [ -0.327862 -0.3540563 -0.1775323 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.328190960359585e-09 1.014603499294547e-09 -1.27771967310413e-09 ] [ 3.880087253188608e-10 -5.795284324747546e-10 2.037939502043102e-09 ] [ 1.465475066289454e-09 1.32185499269497e-10 -4.757815682244576e-10 ] [ -5.252928312487296e-10 -5.67260726306951e-10 -2.844381004968518e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2527073 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.482447131516549e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0136123 3.8503187 1.20502 ] [ 2.2142296 3.5159775 3.4776176 ] [ 4.2738819 4.2857056 1.069555 ] [ 4.4745072 3.9513202 3.3421454 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0136123e-10 3.8503187e-10 1.20502e-10 ] [ 2.2142296e-10 3.5159775e-10 3.4776176e-10 ] [ 4.2738819e-10 4.2857056e-10 1.069555e-10 ] [ 4.4745072e-10 3.9513202e-10 3.3421454e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.4e-06 6.3e-06 3.4e-06 ] [ 5e-07 -6.3e-06 -1e-07 ] [ 1.2e-06 -5.9e-06 -1.6e-06 ] [ -4.1e-06 5.9e-06 -1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.84522388992e-15 1.009371271104e-14 5.44740051072e-15 ] [ 8.010883104e-16 -1.009371271104e-14 -1.6021766208e-16 ] [ 1.92261194496e-15 -9.45284206272e-15 -2.56348259328e-15 ] [ -6.568924145279999e-15 9.45284206272e-15 -2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.6673908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.548886752389701e-18 } }