{ "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" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0263172 -1.2146583 -8.1633149 ] [ -14.090319 -9.3919191 4.504464 ] [ 9.1852657 -5.083486 -7.113302 ] [ 3.031304 2.1579448 15.7255172 ] [ 3.9000666 13.5321186 -4.9533643 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.246518044164918e-09 -1.946097130520673e-09 -1.307907228100829e-08 ] [ -2.257517968141403e-08 -1.504751320646498e-08 7.216946910035251e-09 ] [ 1.471641796037615e-08 -8.14464242136411e-09 -1.139676616108988e-08 ] [ 4.856684399337523e-09 3.457408707536932e-09 2.519505600782828e-08 ] [ 6.248595526082946e-09 2.168084405081283e-08 -7.936164475765357e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.8779166 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.213107313932225e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.933554 2.0767306 0.263906 ] [ 2.3816356 0.976129 3.9806226 ] [ 3.5750923 1.8821043 2.0006035 ] [ 2.6400591 3.3208137 5.0365131 ] [ 3.873139 4.1659813 2.9283314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.933554e-10 2.0767306e-10 2.63906e-11 ] [ 2.3816356e-10 9.76129e-11 3.9806226e-10 ] [ 3.5750923e-10 1.8821043e-10 2.0006035e-10 ] [ 2.6400591e-10 3.3208137e-10 5.0365131e-10 ] [ 3.873139e-10 4.1659813e-10 2.9283314e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.6e-06 -9.4e-06 -3.13e-05 ] [ -7e-07 1e-07 6.6e-06 ] [ -1.65e-05 -1.1e-06 -3e-06 ] [ 8.7e-06 -1e-07 2.97e-05 ] [ 1.8e-06 1.05e-05 -2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.057436569728e-14 -1.506046023552e-14 -5.014812823104e-14 ] [ -1.12152363456e-15 1.6021766208e-16 1.057436569728e-14 ] [ -2.64359142432e-14 -1.76239428288e-15 -4.8065298624e-15 ] [ 1.393893660096e-14 -1.6021766208e-16 4.758464563776e-14 ] [ 2.88391791744e-15 1.68228545184e-14 -3.2043532416e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }