{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.302862 -2.0667041 -2.446798 ] [ -2.7797056 0.8210495 1.0129966 ] [ -0.6104416 1.3777263 1.299273 ] [ -0.4537101 0.2316166 -1.3532544 ] [ 2.5409954 -0.3636882 1.4877827 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.087415053726508e-09 -3.311225018411999e-09 -3.920202583717931e-09 ] [ -4.45357936171895e-09 1.315466324257383e-09 1.622999482841444e-09 ] [ -9.780352679415744e-10 2.207360885907274e-09 2.081664841787082e-09 ] [ -7.269237208298033e-10 3.710907045665244e-10 -2.168152579537689e-09 ] [ 4.071123456981483e-09 -5.826927361015187e-10 2.383690678409431e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.4971 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.84203849787614e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9383042 2.2631761 0.0628664 ] [ -0.4120935 2.9971674 1.7960874 ] [ 1.7316293 0.1472734 0.3348935 ] [ 2.5879168 0.6440952 2.3577935 ] [ 1.8548184 2.7949414 2.2280448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.383042000000001e-11 2.2631761e-10 6.286640000000001e-12 ] [ -4.120935e-11 2.9971674e-10 1.7960874e-10 ] [ 1.7316293e-10 1.472734e-11 3.348935e-11 ] [ 2.5879168e-10 6.440952e-11 2.3577935e-10 ] [ 1.8548184e-10 2.7949414e-10 2.2280448e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 0.0 1e-07 ] [ 9e-07 -3e-07 -5e-07 ] [ -8e-07 9e-07 -0.0 ] [ 8e-07 0.0 6e-07 ] [ -7e-07 -6e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.204353268e-16 0.0 1.602176634e-16 ] [ 1.4419589706e-15 -4.806529901999999e-16 -8.010883169999999e-16 ] [ -1.2817413072e-15 1.4419589706e-15 0.0 ] [ 1.2817413072e-15 0.0 9.613059803999998e-16 ] [ -1.1215236438e-15 -9.613059803999998e-16 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -14.287503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.28911034648049e-18 } }