{ "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" [ [ 0.9991242 0.9479007 1.187372 ] [ 1.085399 0.1016804 2.948528 ] [ 2.969901 0.5974891 1.991295 ] [ 2.924101 2.886024 0.3835606 ] [ 2.264584 2.996261 2.274235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.991242000000001e-11 9.479007e-11 1.187372e-10 ] [ 1.085399e-10 1.016804e-11 2.948528e-10 ] [ 2.969901e-10 5.974891e-11 1.991295e-10 ] [ 2.924101e-10 2.886024e-10 3.835606e-11 ] [ 2.264584e-10 2.996261e-10 2.274235e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8261556 8.0463669 -13.7590705 ] [ -5.0542467 -9.518974 13.5214309 ] [ 11.3072423 -0.0152431 -0.0287785 ] [ 2.4815124 -2.8271988 -9.7249922 ] [ -2.9083525 4.3150491 9.9914103 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.334530291462998e-09 1.289170092955897e-08 -2.204446107903896e-08 ] [ -8.09779589849555e-09 -1.525107759680306e-08 2.166372046774271e-08 ] [ 1.811619925878082e-08 -2.442213844851648e-11 -4.61082398816928e-11 ] [ 3.975821151505299e-09 -4.529671819713815e-09 -1.558115514030236e-08 ] [ -4.659694380545233e-09 6.913470785624082e-09 1.600800399148032e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.1967532 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.121763239507587e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4399395 1.7063215 1.1714848 ] [ 1.3463367 -0.2021932 2.4233971 ] [ 3.5125894 0.9534214 2.4798155 ] [ 2.8078685 1.9612074 0.2359187 ] [ 2.136375 3.1105981 2.4743744 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.399395e-11 1.7063215e-10 1.1714848e-10 ] [ 1.3463367e-10 -2.021932e-11 2.4233971e-10 ] [ 3.5125894e-10 9.534214e-11 2.4798155e-10 ] [ 2.8078685e-10 1.9612074e-10 2.359187e-11 ] [ 2.136375e-10 3.1105981e-10 2.4743744e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.97e-05 3.35e-05 2.19e-05 ] [ 1.45e-05 -7.9e-05 -1.87e-05 ] [ 2.2e-06 -6.1e-06 5.87e-05 ] [ 1.07e-05 1.09e-05 -2.73e-05 ] [ 2.22e-05 4.07e-05 -3.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.962817805376001e-14 5.36729167968e-14 3.508766799552e-14 ] [ 2.32315610016e-14 -1.265719530432e-13 -2.996070280896e-14 ] [ 3.52478856576e-15 -9.77327738688e-15 9.404776764096e-14 ] [ 1.714328984256e-14 1.746372516672e-14 -4.373942174784e-14 ] [ 3.556832098176e-14 6.520858846656e-14 -5.543531107968001e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.977047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.758716806882278e-18 } }