{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2376077 -0.3432216 -0.525676 ] [ -1.5951215 -1.8983408 2.4049248 ] [ 0.2897647 -0.2861342 -0.0599094 ] [ -0.3077655 0.9963106 0.068486 ] [ 1.85073 1.5313859 -1.8878253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.806895049984818e-10 -5.499016278040944e-10 -8.422258042545839e-10 ] [ -2.555666395691031e-09 -3.041477273128867e-09 3.853114321087122e-09 ] [ 4.642542316980197e-10 -4.584375294282828e-10 -9.59854408369596e-11 ] [ -4.930946928513269e-10 1.59626556352652e-09 1.09726668956124e-10 ] [ 2.965196361842819e-09 2.453550706617061e-09 -3.02462958473404e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.234137 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.120342507255486e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8769331 2.6219928 1.7278815 ] [ 2.2863576 2.5544325 5.0406478 ] [ 0.5380362 1.9782001 3.5626008 ] [ 1.4378536 4.2504542 3.4977331 ] [ 3.6252538 3.1982375 3.2059329 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8769331e-10 2.6219928e-10 1.7278815e-10 ] [ 2.2863576e-10 2.5544325e-10 5.0406478e-10 ] [ 5.380362e-11 1.9782001e-10 3.5626008e-10 ] [ 1.4378536e-10 4.2504542e-10 3.4977331e-10 ] [ 3.6252538e-10 3.1982375e-10 3.2059329e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.5e-06 8.3e-06 2.44e-05 ] [ 1.04e-05 3.5e-06 3.9e-06 ] [ -2.7e-06 -4.3e-06 -1.28e-05 ] [ 3.5e-06 -3e-07 -6.2e-06 ] [ -2.07e-05 -7.2e-06 -9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.5220678023e-14 1.32980660622e-14 3.909310986959999e-14 ] [ 1.66626369936e-14 5.607618218999999e-15 6.248488872599999e-15 ] [ -4.3258769118e-15 -6.8893595262e-15 -2.05078609152e-14 ] [ 5.607618218999999e-15 -4.806529901999999e-16 -9.9334951308e-15 ] [ -3.316505632379999e-14 -1.15356717648e-14 -1.49002426962e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }