{ "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" [ [ 1.368967 3.862197 2.346954 ] [ 2.915655 3.525719 0.4290147 ] [ 3.711297 1.607736 1.156277 ] [ 3.762397 3.78477 2.460668 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.368967e-10 3.862197e-10 2.346954e-10 ] [ 2.915655e-10 3.525719e-10 4.290147e-11 ] [ 3.711297e-10 1.607736e-10 1.156277e-10 ] [ 3.762397e-10 3.78477e-10 2.460668e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2083404 -0.0955419 -0.4051353 ] [ -2.3007663 1.925607 -3.051352 ] [ 0.8909159 -1.4562082 1.2682043 ] [ 1.20151 -0.373857 2.1882829 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.337981180481203e-10 -1.530749984868115e-10 -6.490983059207942e-10 ] [ -3.686233975784519e-09 3.085162516248826e-09 -4.888804836231322e-09 ] [ 1.427404626078991e-09 -2.333102733057251e-09 2.03188727985803e-09 ] [ 1.925031231657408e-09 -5.989849449224256e-10 3.506015702076424e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.618886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.541115426734043e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5810893 3.3549961 2.2355738 ] [ 2.9271609 3.8189948 0.224227 ] [ 3.2707623 1.7274829 1.4813025 ] [ 3.9793035 3.8789483 2.4518103 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5810893e-10 3.354996100000001e-10 2.2355738e-10 ] [ 2.9271609e-10 3.8189948e-10 2.24227e-11 ] [ 3.2707623e-10 1.7274829e-10 1.4813025e-10 ] [ 3.9793035e-10 3.8789483e-10 2.4518103e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.27e-05 1e-07 2.6e-06 ] [ 4.9e-06 -1.5e-06 5.6e-06 ] [ 1.5e-06 -2.7e-06 -3.5e-06 ] [ 6.3e-06 4.1e-06 -4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.034764308416e-14 1.6021766208e-16 4.16565921408e-15 ] [ 7.850665441919999e-15 -2.4032649312e-15 8.972189076479999e-15 ] [ 2.4032649312e-15 -4.32587687616e-15 -5.6076181728e-15 ] [ 1.009371271104e-14 6.568924145279999e-15 -7.370012455680001e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.560332 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.852169365908611e-18 } }