{ "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" [ [ 0.8888047 2.050538 1.655197 ] [ 2.913325 1.361036 3.047712 ] [ 2.022581 2.448681 4.72594 ] [ 1.815806 3.470528 2.839754 ] [ 4.233041 2.418243 4.364549 ] [ 4.034854 4.068796 2.809397 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.888047000000001e-11 2.050538e-10 1.655197e-10 ] [ 2.913325e-10 1.361036e-10 3.047712e-10 ] [ 2.022581e-10 2.448681e-10 4.72594e-10 ] [ 1.815806e-10 3.470528e-10 2.839754e-10 ] [ 4.233041e-10 2.418243e-10 4.364549e-10 ] [ 4.034854000000001e-10 4.068796e-10 2.809397e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.7460475 -3.6046233 -11.9533043 ] [ 5.4986204 -37.1449775 -10.0828702 ] [ -16.3373094 -1.113492 26.8479511 ] [ -21.1938101 26.2328124 -10.9888434 ] [ 27.5167943 -2.7018194 14.9862164 ] [ 13.2617522 18.3320999 -8.8091496 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.401271282890629e-08 -5.775243178050945e-09 -1.915130469076811e-08 ] [ 8.809761051533943e-09 -5.951281453064204e-08 -1.615453890500102e-08 ] [ -2.617525516745607e-08 -1.784010849847834e-09 4.301515956880164e-08 ] [ -3.395622704789491e-08 4.202959872511234e-08 -1.760606798511238e-08 ] [ 4.408676450682271e-08 -4.328791876303884e-09 2.401056555032954e-08 ] [ 2.124766932568296e-08 2.937126186995002e-08 -1.411381353824967e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.593715 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.177953236281827e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3259727 1.9120977 1.717381 ] [ 3.1425854 0.6432739 2.6179423 ] [ 1.9011636 2.9399552 5.1816842 ] [ 1.4945609 3.9587095 2.93695 ] [ 4.0683373 2.1610699 4.2128255 ] [ 3.9757918 4.2027157 2.7757659 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3259727e-10 1.9120977e-10 1.717381e-10 ] [ 3.1425854e-10 6.432738999999999e-11 2.6179423e-10 ] [ 1.9011636e-10 2.9399552e-10 5.181684200000001e-10 ] [ 1.4945609e-10 3.9587095e-10 2.93695e-10 ] [ 4.0683373e-10 2.1610699e-10 4.2128255e-10 ] [ 3.9757918e-10 4.2027157e-10 2.7757659e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.71e-05 1.65e-05 7.5e-06 ] [ 2.43e-05 7.1e-06 -8.8e-06 ] [ -1.13e-05 1.99e-05 -1.19e-05 ] [ 4.66e-05 -3.78e-05 -9e-07 ] [ -1.6e-06 1.75e-05 -9.2e-06 ] [ -2.09e-05 -2.31e-05 2.34e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.944075263168e-14 2.64359142432e-14 1.2016324656e-14 ] [ 3.893289188544e-14 1.137545400768e-14 -1.409915426304e-14 ] [ -1.810459581504e-14 3.188331475392e-14 -1.906590178752e-14 ] [ 7.466143052928e-14 -6.056227626623999e-14 -1.44195895872e-15 ] [ -2.56348259328e-15 2.8038090864e-14 -1.474002491136e-14 ] [ -3.348549137472e-14 -3.701027994048e-14 3.749093292672001e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.021911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246557798313835e-18 } }