{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2032241 -6.5206243 -2.4549892 ] [ -4.1152346 0.9408311 6.8338618 ] [ -1.9520524 4.7738398 -3.5443944 ] [ 2.7082246 -0.9496054 0.5653634 ] [ 4.5622865 1.7555587 -1.3998416 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.927777522603121e-09 -1.044719180648037e-08 -3.933326300556496e-09 ] [ -6.59333266522724e-09 1.507377592541547e-09 1.094905360573821e-08 ] [ -3.12753271785653e-09 7.648534519004547e-09 -5.678745842574443e-09 ] [ 4.339054137995431e-09 -1.521435570865433e-09 9.058120217359987e-10 ] [ 7.309588767691459e-09 2.812715105582041e-09 -2.242793484343265e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.1103317 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.98330073267312e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6590851 1.3378676 2.2862652 ] [ 0.9086885 3.0952574 5.2334183 ] [ 1.4725066 3.5543194 1.7163788 ] [ 3.6911741 1.3619654 3.3550376 ] [ 3.5045956 3.5784172 2.7851511 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6590851e-10 1.3378676e-10 2.2862652e-10 ] [ 9.086885e-11 3.0952574e-10 5.233418300000001e-10 ] [ 1.4725066e-10 3.5543194e-10 1.7163788e-10 ] [ 3.6911741e-10 1.3619654e-10 3.3550376e-10 ] [ 3.5045956e-10 3.5784172e-10 2.7851511e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 0.0 4e-07 ] [ 0.0 0.0 0.0 ] [ -2e-07 3e-07 -2e-07 ] [ -4e-07 2e-07 -3e-07 ] [ -0.0 -5e-07 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 0.0 6.408706483200001e-16 ] [ 0.0 0.0 0.0 ] [ -3.2043532416e-16 4.8065298624e-16 -3.2043532416e-16 ] [ -6.408706483200001e-16 3.2043532416e-16 -4.8065298624e-16 ] [ 0.0 -8.010883104e-16 1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.873935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.902414105389885e-18 } }