{ "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" [ [ 0.9701738 0.435353 0.8614305 ] [ 0.785215 2.880742 2.663197 ] [ 2.41347 1.4145 0.9828772 ] [ 2.657499 1.219941 2.828683 ] [ 1.63309 2.566255 0.271655 ] [ 2.657105 2.943765 2.654332 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.701738e-11 4.35353e-11 8.614305e-11 ] [ 7.85215e-11 2.880742e-10 2.663197e-10 ] [ 2.41347e-10 1.4145e-10 9.828772e-11 ] [ 2.657499e-10 1.219941e-10 2.828683e-10 ] [ 1.63309e-10 2.566255e-10 2.71655e-11 ] [ 2.657105e-10 2.943765e-10 2.654332e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.7787425 -16.2722357 -3.8511043 ] [ -19.1847026 10.6004133 8.4993291 ] [ 26.4930071 -19.8935988 -10.8804014 ] [ 10.5314362 -19.0810164 19.9233587 ] [ -13.3050846 24.7108662 -23.5643471 ] [ 11.2440863 19.9355715 9.8731651 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.528033233912334e-08 -2.607099560668712e-08 -6.170149273722349e-09 ] [ -3.073728198272098e-08 1.698373436007738e-08 1.361742637650511e-08 ] [ 4.244647659030841e-08 -3.187305890093494e-08 -1.743232474799959e-08 ] [ 1.687322086308679e-08 -3.057115837718138e-08 3.192073951695229e-08 ] [ -2.131709548388612e-08 3.959117210535694e-08 -3.775424600803628e-08 ] [ 1.801501219211757e-08 3.194030657958679e-08 1.58185542965185e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.842867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.698524773464383e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9441697 -0.7791928 0.5576403 ] [ 1.2008772 4.1466018 2.1819694 ] [ 2.2839267 1.0121533 0.7101835 ] [ 3.1341237 1.1354353 2.78145 ] [ 1.0888846 2.8730308 0.3397825 ] [ 2.4645709 3.0725276 3.6911491 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.441697e-11 -7.791928e-11 5.576403e-11 ] [ 1.2008772e-10 4.1466018e-10 2.1819694e-10 ] [ 2.2839267e-10 1.0121533e-10 7.101835e-11 ] [ 3.1341237e-10 1.1354353e-10 2.78145e-10 ] [ 1.0888846e-10 2.8730308e-10 3.397825e-11 ] [ 2.4645709e-10 3.0725276e-10 3.6911491e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.16e-05 -4.5e-06 -8.5e-06 ] [ -1.62e-05 -3.8e-06 8.9e-06 ] [ -3.6e-06 8.3e-06 3.8e-06 ] [ -4.7e-06 1.22e-05 -3e-07 ] [ 2.57e-05 -1.47e-05 8e-06 ] [ 1.04e-05 2.6e-06 -1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.858524880128e-14 -7.2097947936e-15 -1.36185012768e-14 ] [ -2.595526125696e-14 -6.08827115904e-15 1.425937192512e-14 ] [ -5.76783583488e-15 1.329806595264e-14 6.08827115904e-15 ] [ -7.53023011776e-15 1.954655477376e-14 -4.8065298624e-16 ] [ 4.117593915456e-14 -2.355199632576e-14 1.28174129664e-14 ] [ 1.666263685632e-14 4.16565921408e-15 -1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.762499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.724342427918338e-18 } }