{ "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" [ [ 0.4656555 2.854978 2.130075 ] [ 2.415045 0.7163998 1.216409 ] [ 1.531563 1.029003 2.475027 ] [ 2.019704 2.428405 0.6522284 ] [ 2.764103 2.749341 2.416687 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.656555e-11 2.854978e-10 2.130075e-10 ] [ 2.415045e-10 7.163998000000001e-11 1.216409e-10 ] [ 1.531563e-10 1.029003e-10 2.475027e-10 ] [ 2.019704e-10 2.428405e-10 6.522284e-11 ] [ 2.764103e-10 2.749341e-10 2.416687e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.3620582 9.9104089 2.0503699 ] [ 36.1952878 -35.7954602 -41.2822786 ] [ -36.2066935 -12.8363375 56.0052106 ] [ -4.8445833 22.7036554 -35.9024271 ] [ 20.2180472 16.0177334 19.1291253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.461273049540893e-08 1.587822544214824e-08 3.285054717772034e-09 ] [ 5.799124389628747e-08 -5.735064946321689e-08 -6.614150162627215e-08 ] [ -5.800951784217133e-08 -2.056607983919832e-08 8.973023906630034e-08 ] [ -7.761878100778113e-09 3.637526588857967e-08 -5.752202932959635e-08 ] [ 3.23928825420709e-08 2.56632379716873e-08 3.064823733201378e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 41.938988 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.719366607361176e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4246859 2.7573538 2.8307262 ] [ 2.8237886 0.2907567 0.3191352 ] [ 0.2679265 0.8878353 2.8426727 ] [ 2.3884377 2.085659 0.0552091 ] [ 3.2912318 3.7565219 2.8426833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.246859e-11 2.7573538e-10 2.8307262e-10 ] [ 2.8237886e-10 2.907567e-11 3.191352e-11 ] [ 2.679265e-11 8.878353e-11 2.8426727e-10 ] [ 2.3884377e-10 2.085659e-10 5.52091e-12 ] [ 3.2912318e-10 3.7565219e-10 2.8426833e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.9091817 0.2876589 0.0277401 ] [ -0.0476597 -0.0651337 -0.1375701 ] [ 0.3505603 0.3712936 -0.0002672 ] [ 0.0974543 -0.0054795 0.1637697 ] [ -1.3095365 -0.5883394 -0.0536725 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.456669663799199e-09 4.608803643450452e-10 4.444453967865408e-11 ] [ -7.635925709434176e-11 -1.04355691366201e-10 -2.204115979411181e-10 ] [ 5.616595168406342e-10 5.948779253726669e-10 -4.2810159307776e-13 ] [ 1.561390010564294e-10 -8.779126793673601e-12 2.623879845354298e-10 ] [ -2.098108764384259e-09 -9.426236317754994e-10 -8.5992824679888e-11 ] ] } "relaxed-potential-energy" { "source-value" -21.638653 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.466894394220379e-18 } }