{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0915456 -1.7050009 -7.2064946 ] [ 3.7122476 0.5363271 -0.512091 ] [ -4.9461041 -2.8553559 7.7086592 ] [ -3.2616089 -1.9406713 -1.2346684 ] [ 1.7656184 1.8423737 0.7971495 ] [ -0.4632195 -0.229923 -1.1600074 ] [ 6.2846121 4.3522503 1.6074527 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.953202082457109e-09 -2.731712580422959e-09 -1.154607716604145e-08 ] [ 5.947676315340911e-09 8.592907407214635e-10 -8.204602279220928e-10 ] [ -7.924532353063025e-09 -4.574784467043343e-09 1.235063354795483e-08 ] [ -5.225673525773205e-09 -3.109298185517543e-09 -1.978156844920543e-09 ] [ 2.828832521734303e-09 2.951808068916793e-09 1.277174292182409e-09 ] [ -7.421594531986655e-10 -3.683772551841984e-10 -1.858536736234994e-09 ] [ 1.006905857741679e-08 6.973073678529786e-09 2.575423134981837e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.778107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.329019725988083e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0254053 3.3840244 1.9352187 ] [ 2.403107 0.9760103 2.3763544 ] [ 2.6227859 2.6756595 4.2708718 ] [ 4.6069025 0.2198972 2.4697127 ] [ 5.0621596 2.0724238 3.8106114 ] [ 3.9124171 4.2435068 0.6814666 ] [ 4.1680166 4.2674898 3.0909233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0254053e-10 3.3840244e-10 1.9352187e-10 ] [ 2.403107e-10 9.760103e-11 2.3763544e-10 ] [ 2.6227859e-10 2.6756595e-10 4.2708718e-10 ] [ 4.606902500000001e-10 2.198972e-11 2.4697127e-10 ] [ 5.0621596e-10 2.0724238e-10 3.8106114e-10 ] [ 3.9124171e-10 4.2435068e-10 6.814666e-11 ] [ 4.1680166e-10 4.2674898e-10 3.0909233e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.6e-06 1.8e-06 -4.58e-05 ] [ -1e-06 -1.44e-05 -2.4e-05 ] [ 1.8e-05 2.27e-05 2.13e-05 ] [ -1.95e-05 -3.1e-06 -1.16e-05 ] [ 4.68e-05 -3.2e-05 3.99e-05 ] [ -2.59e-05 -1.29e-05 -1.19e-05 ] [ -8.8e-06 3.79e-05 3.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.538089555968e-14 2.88391791744e-15 -7.337968923264e-14 ] [ -1.6021766208e-15 -2.307134333952e-14 -3.84522388992e-14 ] [ 2.88391791744e-14 3.636940929216e-14 3.412636202304e-14 ] [ -3.12424441056e-14 -4.96674752448e-15 -1.858524880128e-14 ] [ 7.498186585344001e-14 -5.12696518656e-14 6.392684716992e-14 ] [ -4.149637447872e-14 -2.066807840832e-14 -1.906590178752e-14 ] [ -1.409915426304e-14 6.072249392832e-14 5.142986952768e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.602454 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.941747661310745e-18 } }