{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.336271 1.731327 1.289714 ] [ 2.769645 4.287083 1.737277 ] [ 4.480326 1.077167 0.108092 ] [ 5.392167 2.307543 2.197028 ] [ 3.12468 2.46702 3.187134 ] [ 4.416093 3.533887 0.3236582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.336271e-10 1.731327e-10 1.289714e-10 ] [ 2.769645e-10 4.287083e-10 1.737277e-10 ] [ 4.480326e-10 1.077167e-10 1.08092e-11 ] [ 5.392167e-10 2.307543e-10 2.197028e-10 ] [ 3.12468e-10 2.467020000000001e-10 3.187134e-10 ] [ 4.416093e-10 3.533887e-10 3.236582e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5672362 -5.2995947 -3.2499891 ] [ -1.5715325 4.5091502 -0.0794403 ] [ -0.4895012 -1.8867277 -0.7351114 ] [ 2.3231719 -0.4975029 2.3470711 ] [ 1.5947207 -0.5497136 5.2218142 ] [ 2.7103773 3.7243887 -3.5043444 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.317519061311433e-09 -8.49088672805559e-09 -5.207056553874834e-09 ] [ -2.517872630327376e-09 7.224455030115644e-09 -1.272773914093383e-10 ] [ -7.84267378493545e-10 -3.022871010755756e-09 -1.177778298763557e-09 ] [ 3.722131704279516e-09 -7.970875151602005e-10 3.760422443775339e-09 ] [ 2.555024222245811e-09 -8.80738278055803e-10 8.366268629401455e-09 ] [ 4.342503143607028e-09 5.967128501911705e-09 -5.614578668911403e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.11904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.941684255454003e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1345514 1.5561928 1.2574011 ] [ 2.6024702 4.1050918 1.4519446 ] [ 4.2477341 1.2516693 0.1647234 ] [ 5.4659641 2.1929623 2.2584263 ] [ 3.3527687 2.497564 3.3510569 ] [ 4.7156935 3.8005467 0.3593509 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1345514e-10 1.5561928e-10 1.2574011e-10 ] [ 2.6024702e-10 4.1050918e-10 1.4519446e-10 ] [ 4.2477341e-10 1.2516693e-10 1.647234e-11 ] [ 5.4659641e-10 2.1929623e-10 2.2584263e-10 ] [ 3.3527687e-10 2.497564e-10 3.3510569e-10 ] [ 4.715693500000001e-10 3.8005467e-10 3.593509e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.82e-05 3.5e-06 -3.22e-05 ] [ 1.47e-05 7e-06 3.36e-05 ] [ 2.47e-05 -1.2e-05 2.94e-05 ] [ -5.6e-06 3.71e-05 -3.84e-05 ] [ -1.11e-05 -1.36e-05 2.02e-05 ] [ 5.5e-06 -2.2e-05 -1.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.518138070656001e-14 5.6076181728e-15 -5.159008718975999e-14 ] [ 2.355199632576e-14 1.12152363456e-14 5.383313445888e-14 ] [ 3.957376253376001e-14 -1.92261194496e-14 4.710399265152e-14 ] [ -8.972189076479999e-15 5.944075263168e-14 -6.152358223872e-14 ] [ -1.778416049088e-14 -2.178960204288e-14 3.236396774016e-14 ] [ 8.8119714144e-15 -3.52478856576e-14 -2.018742542208e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.187542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273094809901807e-18 } }