{ "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" [ [ 1.137834 0.6178187 0.8180482 ] [ 0.8147489 0.2195668 2.521416 ] [ 0.6602072 2.742467 0.5700192 ] [ 2.747217 2.135327 0.0253318 ] [ 2.249122 2.278269 1.668886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.137834e-10 6.178187000000001e-11 8.180482000000001e-11 ] [ 8.147489e-11 2.195668e-11 2.521416e-10 ] [ 6.602072e-11 2.742467e-10 5.700191999999999e-11 ] [ 2.747217e-10 2.135327e-10 2.53318e-12 ] [ 2.249122e-10 2.278269e-10 1.668886e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5102793 -17.8421011 -30.6808439 ] [ -7.1266445 -5.5050434 26.3812701 ] [ -18.5200458 13.0256982 -6.084296 ] [ 15.5467067 -1.3393781 -31.9488532 ] [ 11.610263 11.6608244 42.332723 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.41973418533819e-09 -2.858619724836996e-08 -4.91561308029943e-08 ] [ -1.14181432026529e-08 -8.820051831969342e-09 4.226745418123007e-08 ] [ -2.967238439690523e-08 2.086946912563664e-08 -9.748116805226957e-09 ] [ 2.490857000517472e-08 -2.145920278231525e-09 -5.118770565841127e-08 ] [ 1.860169193993927e-08 1.868270023293419e-08 6.782449908540244e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 22.329919 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.577647416615771e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4775395 -0.1591166 0.7995852 ] [ 0.7847049 -0.4363053 2.6193939 ] [ -0.0252261 3.2942811 0.2125832 ] [ 3.3222109 2.2738096 0.1418583 ] [ 3.0499 3.0207797 1.8302807 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.775395e-11 -1.591166e-11 7.995852e-11 ] [ 7.847049000000001e-11 -4.363053e-11 2.6193939e-10 ] [ -2.52261e-12 3.2942811e-10 2.125832e-11 ] [ 3.3222109e-10 2.2738096e-10 1.418583e-11 ] [ 3.0499e-10 3.0207797e-10 1.8302807e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -21.568291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.455621159081105e-18 } }