{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7731508 0.3674594 0.0216017 ] [ -1.6952539 4.3518177 1.0927862 ] [ -14.1872234 -3.9112918 -10.0789314 ] [ 3.8218543 -5.6125163 1.1537954 ] [ -1.6188363 -0.4150481 1.3501576 ] [ 13.0005644 6.9307946 -4.4601949 ] [ -0.0942558 -1.7112155 10.9207854 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.238724136112817e-09 5.887348597731956e-10 3.460973870953536e-11 ] [ -2.716096164900021e-09 6.972380576923628e-09 1.750836501172873e-09 ] [ -2.273043764554669e-08 -6.26658027908675e-09 -1.614822825172702e-08 ] [ 6.123285607563949e-09 -8.99224239971892e-09 1.848584015066584e-09 ] [ -2.593661672762375e-09 -6.649803623274604e-10 2.163190941115438e-09 ] [ 2.082920033888478e-08 1.110435707168689e-08 -7.146019992991394e-09 ] [ -1.510144391348006e-10 -2.741669467250583e-09 1.749702704865398e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.9234131 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.081647500960453e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1840954 1.7751762 3.119309 ] [ 2.9259451 5.8474706 2.2560946 ] [ 2.3697771 3.5068048 1.5017788 ] [ 4.7076793 1.9005845 1.9200295 ] [ 5.4815851 2.8154422 3.9989235 ] [ 5.0592117 4.9575958 1.9899024 ] [ 3.6450094 3.902417 4.5419352 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1840954e-10 1.7751762e-10 3.119309e-10 ] [ 2.9259451e-10 5.8474706e-10 2.2560946e-10 ] [ 2.3697771e-10 3.5068048e-10 1.5017788e-10 ] [ 4.7076793e-10 1.9005845e-10 1.9200295e-10 ] [ 5.481585100000001e-10 2.8154422e-10 3.9989235e-10 ] [ 5.0592117e-10 4.9575958e-10 1.9899024e-10 ] [ 3.6450094e-10 3.902417e-10 4.5419352e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2240581 1.0229324 -1.0427476 ] [ 0.9172202 0.5343293 -0.4164248 ] [ -2.3870912 -0.4628458 -0.0606995 ] [ 3.9259129 -0.0052711 2.7464657 ] [ -1.2174404 -1.0028331 -0.2441575 ] [ -1.690992 1.6088917 -0.9635724 ] [ 2.6764488 -1.6952034 -0.0188639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.563333891120869e-09 1.638918375938834e-09 -1.67066582611531e-09 ] [ 1.4695487605655e-09 8.560899122684294e-10 -6.671860788813158e-10 ] [ -3.824541712357417e-09 -7.415607197954726e-10 -9.72513197942496e-11 ] [ 6.290005863677128e-09 -8.44523318589888e-12 4.400323134369106e-09 ] [ -1.950554546097401e-09 -1.606715747384388e-09 -3.91183438292976e-10 ] [ -2.709267848359834e-09 2.577728667139167e-09 -1.543813171728146e-09 ] [ 4.288143694128216e-09 -2.716015254980671e-09 -3.022329955710912e-11 ] ] } "relaxed-potential-energy" { "source-value" -14.888403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.385385120764858e-18 } }