{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1527245 -4.8223343 -7.7231618 ] [ -2.0351064 5.0931921 -2.997405 ] [ -3.5961206 2.8610861 9.1527815 ] [ 1.7055014 -7.0922966 2.5587961 ] [ 9.0784501 3.9603527 -0.9910109 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.25557472732337e-09 -7.726231273141932e-09 -1.237386927461565e-08 ] [ -3.260599894920453e-09 8.160193307863255e-09 -4.802372214069024e-09 ] [ -5.761620350897269e-09 4.583965259515851e-09 1.466437253459076e-08 ] [ 2.732514469821669e-09 -1.136311180029933e-08 4.099643288814218e-09 ] [ 1.454528050331942e-08 6.345184506062157e-09 -1.587774494937967e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.86825265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.391094096777645e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6404911 2.7791775 1.0639705 ] [ 2.0643818 5.1422882 1.7915066 ] [ 1.7058701 4.1329207 4.0599836 ] [ 3.0856724 2.2938986 3.0562626 ] [ 4.3787416 4.2422009 2.1477347 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6404911e-10 2.7791775e-10 1.0639705e-10 ] [ 2.0643818e-10 5.1422882e-10 1.7915066e-10 ] [ 1.7058701e-10 4.1329207e-10 4.0599836e-10 ] [ 3.0856724e-10 2.2938986e-10 3.0562626e-10 ] [ 4.3787416e-10 4.2422009e-10 2.1477347e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.69e-05 2.11e-05 2.21e-05 ] [ 1.02e-05 -1.75e-05 2.94e-05 ] [ -2.4e-06 -7.1e-06 -4.23e-05 ] [ 9.9e-06 2.83e-05 1.7e-06 ] [ -3.47e-05 -2.47e-05 -1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.707678489152e-14 3.380592669888e-14 3.540810331968e-14 ] [ 1.634220153216e-14 -2.8038090864e-14 4.710399265152e-14 ] [ -3.84522388992e-15 -1.137545400768e-14 -6.777207105984e-14 ] [ 1.586154854592e-14 4.534159836864e-14 2.72370025536e-15 ] [ -5.559552874176001e-14 -3.957376253376001e-14 -1.730350750464e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }