{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.91701 1.98827 2.508844 ] [ 2.572173 1.794465 4.860558 ] [ 4.363165 1.510923 1.91691 ] [ 4.651171 2.095892 4.214607 ] [ 5.448722 3.893309 2.444809 ] [ 3.326625 3.729664 3.343147 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.91701e-10 1.98827e-10 2.508844e-10 ] [ 2.572173e-10 1.794465e-10 4.860558000000001e-10 ] [ 4.363165000000001e-10 1.510923e-10 1.91691e-10 ] [ 4.651171e-10 2.095892e-10 4.214607e-10 ] [ 5.448722e-10 3.893309e-10 2.444809e-10 ] [ 3.326625e-10 3.729664e-10 3.343147e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0502229 -1.26827 -1.3161144 ] [ -3.8462631 -0.9704291 2.2393992 ] [ 1.3917078 -3.6870757 -3.9898442 ] [ 6.46512 -2.0477487 2.1901302 ] [ 2.2923505 0.0052406 -1.08443 ] [ -5.2526924 7.9682829 1.9608592 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.682642577008777e-09 -2.031992542862016e-09 -2.108647721978219e-09 ] [ -6.162392816265732e-09 -1.554798816163985e-09 3.587913042878223e-09 ] [ 2.229761700145002e-09 -5.907346485659794e-09 -6.39243509787448e-09 ] [ 1.03582641146665e-08 -3.280855092413593e-09 3.508975402948028e-09 ] [ 3.67275037777919e-09 8.39636679896448e-12 -1.737448392894144e-09 ] [ -8.415740959533842e-09 1.276659657030042e-08 3.141642766920592e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.190417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.792902449440287e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.095885 1.9354985 2.4027959 ] [ 2.4132218 1.8579836 4.9124688 ] [ 4.4042253 1.4610795 1.7884335 ] [ 4.867149 2.0273224 4.2691867 ] [ 5.3550829 3.7398278 2.3437304 ] [ 3.1433019 3.9908112 3.5722597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.095885e-10 1.9354985e-10 2.4027959e-10 ] [ 2.4132218e-10 1.8579836e-10 4.9124688e-10 ] [ 4.4042253e-10 1.4610795e-10 1.7884335e-10 ] [ 4.867149000000001e-10 2.0273224e-10 4.2691867e-10 ] [ 5.355082900000001e-10 3.7398278e-10 2.3437304e-10 ] [ 3.1433019e-10 3.9908112e-10 3.5722597e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 8.2e-06 -1.79e-05 ] [ -4e-06 -5.4e-06 7.8e-06 ] [ 1.29e-05 -1.21e-05 1.62e-05 ] [ 1.3e-06 5.3e-06 -1.75e-05 ] [ -1.39e-05 -5.5e-06 -6.1e-06 ] [ 3.8e-06 9.5e-06 1.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 1.313784829056e-14 -2.867896151232001e-14 ] [ -6.4087064832e-15 -8.65175375232e-15 1.249697764224e-14 ] [ 2.066807840832e-14 -1.938633711168e-14 2.595526125696e-14 ] [ 2.08282960704e-15 8.491536090240001e-15 -2.8038090864e-14 ] [ -2.227025502912e-14 -8.8119714144e-15 -9.77327738688e-15 ] [ 6.08827115904e-15 1.52206778976e-14 2.819830852608e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.657752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.188213094708444e-18 } }