{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 6.6443335 3.5766339 -2.1972997 ] [ -0.7320924 -4.5301649 5.2809902 ] [ 6.6826386 -1.5485261 -15.5927182 ] [ -12.5948798 2.5020571 12.5090277 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 1.064539579449824e-08 5.730399215740726e-09 -3.520462208230854e-09 ] [ -1.172941327545362e-09 -7.25812429114877e-09 8.461079033113917e-09 ] [ 1.070676733017564e-08 -2.481012314118603e-09 -2.498228855476266e-08 ] [ -2.017922195734618e-08 4.008737389526648e-09 2.00416717298796e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.1006508 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.365613600224817e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.2587966 1.2656032 0.3176773 ] [ 1.47516 0.9102986 1.6256893 ] [ 3.4482473 6.0393617 3.029712 ] [ 3.780902 3.884695 3.3187338 ] [ 3.0665313 1.8634194 2.811103 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.587966e-11 1.2656032e-10 3.176773e-11 ] [ 1.47516e-10 9.102986e-11 1.6256893e-10 ] [ 3.4482473e-10 6.0393617e-10 3.029712e-10 ] [ 3.780902e-10 3.884695e-10 3.3187338e-10 ] [ 3.0665313e-10 1.8634194e-10 2.811103e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0085909 -0.1143128 0.0078038 ] [ -0.0406758 0.0318848 -0.0302875 ] [ 0.0691832 0.1370652 0.0501593 ] [ -0.0876135 -0.330724 -0.0615221 ] [ 0.0505152 0.2760868 0.0338465 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.376413913163072e-11 -1.831492956181863e-10 1.250306591339904e-11 ] [ -6.516981579233663e-11 5.108508111888384e-11 -4.852592440248e-11 ] [ 1.108437055921306e-10 2.196026589652762e-10 8.036405777569344e-11 ] [ -1.403723013664608e-10 -5.298782607374593e-10 -9.85692702825197e-11 ] [ 8.093427243503617e-11 4.423398162714855e-10 5.42280709959072e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.03455 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.767929803104864e-18 } }