{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.714734 1.466262 2.616829 ] [ 1.672695 3.586506 2.191402 ] [ 5.072274 0.9269389 2.177539 ] [ 4.025413 3.317035 2.158848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.714734e-10 1.466262e-10 2.616829e-10 ] [ 1.672695e-10 3.586506e-10 2.191402e-10 ] [ 5.072274e-10 9.269389e-11 2.177539e-10 ] [ 4.025413e-10 3.317035e-10 2.158848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3944669 -1.3708306 0.3182044 ] [ 0.0316535 -0.0385598 -0.0943612 ] [ -1.3107823 1.895242 -0.0086633 ] [ 1.6735958 -0.4858515 -0.2151799 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.320056448594515e-10 -2.196312738397236e-09 5.098196503156915e-10 ] [ 5.07144976664928e-11 -6.177961006272384e-11 -1.51183308550633e-10 ] [ -2.100104756018452e-09 3.036512423158234e-09 -1.388013671897664e-11 ] [ 2.681396063429073e-09 -7.784199144806112e-10 -3.44756205046082e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.342811 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657100997755307e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6938883 1.4339642 2.8527014 ] [ 1.7827366 3.4537667 1.9718127 ] [ 4.8772966 1.0902892 1.9580642 ] [ 4.1311945 3.3187218 2.3620397 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6938883e-10 1.4339642e-10 2.8527014e-10 ] [ 1.7827366e-10 3.4537667e-10 1.9718127e-10 ] [ 4.877296600000001e-10 1.0902892e-10 1.9580642e-10 ] [ 4.1311945e-10 3.3187218e-10 2.3620397e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.27e-05 4.1e-05 3.06e-05 ] [ 1.84e-05 -1.52e-05 -3.44e-05 ] [ -1.71e-05 2.82e-05 -3.46e-05 ] [ -2.4e-05 -5.4e-05 3.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.636940929216e-14 6.56892414528e-14 4.902660459647999e-14 ] [ 2.948004982272e-14 -2.435308463616e-14 -5.511487575552001e-14 ] [ -2.739722021568e-14 4.518138070656001e-14 -5.543531107968001e-14 ] [ -3.84522388992e-14 -8.65175375232e-14 6.136336457664001e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.766829 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.725036170395144e-18 } }