{ "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" [ [ 1.3829764 3.9500653 1.2341312 ] [ -13.0526326 27.8055043 6.9758084 ] [ -46.0249006 -16.7998051 -14.0260953 ] [ 18.6359575 -22.2381425 -0.9175128 ] [ 1.8407698 -1.9927167 0.8114488 ] [ 41.1878465 10.5302861 3.8531266 ] [ -3.9700169 -1.2551914 2.0690931 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.215772473453437e-09 6.328702326434199e-09 1.977296171930381e-09 ] [ -2.091262296390666e-08 4.454932928604652e-08 1.117647722174092e-08 ] [ -7.374002032349258e-08 -2.691625518697403e-08 -2.247228215591722e-08 ] [ 2.985809565871705e-08 -3.562943229706234e-08 -1.470017569555915e-09 ] [ 2.949238362132853e-09 -3.192684134921588e-09 1.300084307047339e-09 ] [ 6.599020526707867e-08 1.687137833875499e-08 6.173389406363864e-09 ] [ -6.360668313765113e-09 -2.011038332277747e-09 3.315052618390625e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.345956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.65760489595921e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2508993 1.6770882 3.240888 ] [ 2.8807067 6.0146654 2.5859312 ] [ 2.5017553 3.6352797 1.400962 ] [ 4.5550604 1.889373 1.9636032 ] [ 5.7876821 2.9945152 4.0239502 ] [ 5.0738868 4.59334 1.9704211 ] [ 3.3233123 3.9012295 4.1422171 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2508993e-10 1.6770882e-10 3.240888e-10 ] [ 2.8807067e-10 6.014665400000001e-10 2.5859312e-10 ] [ 2.5017553e-10 3.6352797e-10 1.400962e-10 ] [ 4.555060400000001e-10 1.889373e-10 1.9636032e-10 ] [ 5.787682099999999e-10 2.9945152e-10 4.0239502e-10 ] [ 5.073886800000001e-10 4.59334e-10 1.9704211e-10 ] [ 3.3233123e-10 3.9012295e-10 4.1422171e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.63e-05 4.1e-05 2.8e-06 ] [ -3.75e-05 -0.0001049 -3.2e-05 ] [ 0.0001126 7.58e-05 0.000123 ] [ -1.8e-05 3.49e-05 -2.1e-05 ] [ 2.4e-05 1.3e-06 1.9e-05 ] [ -8.85e-05 -4.8e-05 4.06e-05 ] [ 3.37e-05 -1e-07 -0.0001323 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.21372454742e-14 6.568924199399999e-14 4.486094575199999e-15 ] [ -6.008162377499999e-14 -1.680683289066e-13 -5.126965228799999e-14 ] [ 1.804050889884e-13 1.214449888572e-13 1.97067725982e-13 ] [ -2.8839179412e-14 5.59159645266e-14 -3.364570931399999e-14 ] [ 3.8452239216e-14 2.0828296242e-15 3.0441356046e-14 ] [ -1.41792632109e-13 -7.690447843199999e-14 6.504837134039999e-14 ] [ 5.399335256579999e-14 -1.602176634e-16 -2.119679686781999e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.768314 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.968321395437507e-18 } }