{ "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" [ [ 1.989482 2.74037 0.7537924 ] [ 0.5238862 4.134075 1.701981 ] [ 2.155499 3.587274 3.303778 ] [ 3.995828 2.956534 2.17043 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.989482e-10 2.74037e-10 7.537924e-11 ] [ 5.238862e-11 4.134075000000001e-10 1.701981e-10 ] [ 2.155499e-10 3.587274e-10 3.303778e-10 ] [ 3.995828e-10 2.956534e-10 2.17043e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.034385 -2.1564259 -5.4607753 ] [ -0.2695733 0.2550951 0.5502595 ] [ -0.1749098 2.2236318 5.7506221 ] [ -0.5899019 -0.322301 -0.8401063 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.657267463906208e-09 -3.454975161467599e-09 -8.749126517102106e-09 ] [ -4.319040388519047e-10 4.087074053006381e-10 8.816129062730976e-10 ] [ -2.802363923088039e-10 3.562650883227422e-09 9.2135122836758e-09 ] [ -9.451270327454995e-10 -5.163831270604608e-10 -1.345998672846791e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.696499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.713768062221058e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1418655 2.8718776 0.5914016 ] [ 0.512864 3.9376678 1.8090578 ] [ 2.1904833 3.8372507 3.3735879 ] [ 3.8194823 2.7714568 2.155934 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1418655e-10 2.8718776e-10 5.914016e-11 ] [ 5.12864e-11 3.9376678e-10 1.8090578e-10 ] [ 2.1904833e-10 3.8372507e-10 3.3735879e-10 ] [ 3.8194823e-10 2.7714568e-10 2.155934e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 1.03e-05 3.68e-05 ] [ 3.5e-06 1.6e-06 3.1e-06 ] [ -1.53e-05 -6.5e-06 -3.01e-05 ] [ 9.8e-06 -5.4e-06 -9.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36457090368e-15 1.650241919424e-14 5.896009964544001e-14 ] [ 5.6076181728e-15 2.56348259328e-15 4.96674752448e-15 ] [ -2.451330229824e-14 -1.04141480352e-14 -4.822551628608e-14 ] [ 1.570133088384e-14 -8.65175375232e-15 -1.570133088384e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.873935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.902414105389885e-18 } }