{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0860864 0.538431 2.860344 ] [ 1.041136 2.407951 2.676466 ] [ 1.788037 0.0757738 1.548631 ] [ 2.92783 1.815427 0.7969909 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.60864e-12 5.38431e-11 2.860344e-10 ] [ 1.041136e-10 2.407951e-10 2.676466e-10 ] [ 1.788037e-10 7.577380000000001e-12 1.548631e-10 ] [ 2.92783e-10 1.815427e-10 7.969909e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.1880245 -14.4272706 7.5249772 ] [ 9.3722718 19.3401083 -1.9220295 ] [ 3.1064087 -14.3109556 -3.7778938 ] [ 3.7093439 9.3981179 -1.825054 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.593607439083761e-08 -2.311503565727519e-08 1.205634254189305e-08 ] [ 1.501603476174314e-08 3.098626936200003e-08 -3.079430729387914e-09 ] [ 4.97701539378972e-09 -2.292867848362683e-08 -6.052853122225271e-09 ] [ 5.943024075087094e-09 1.505744477890199e-08 -2.924058850497523e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1184689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.802867826671894e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1243156 0.5192917 2.9111453 ] [ 1.0841394 2.8183395 2.6159675 ] [ 1.8373888 -0.3995438 1.3252281 ] [ 2.7972456 1.8994955 1.0300909 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.243156e-11 5.192917e-11 2.9111453e-10 ] [ 1.0841394e-10 2.8183395e-10 2.6159675e-10 ] [ 1.8373888e-10 -3.995438e-11 1.3252281e-10 ] [ 2.7972456e-10 1.8994955e-10 1.0300909e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.15e-05 -8.4e-06 8.7e-06 ] [ 3.6e-06 -3.3e-06 3.5e-06 ] [ 3.4e-06 3.1e-06 4.9e-06 ] [ 1.45e-05 8.6e-06 -1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.44467973472e-14 -1.345828361472e-14 1.393893660096e-14 ] [ 5.76783583488e-15 -5.28718284864e-15 5.6076181728e-15 ] [ 5.44740051072e-15 4.96674752448e-15 7.850665441919999e-15 ] [ 2.32315610016e-14 1.377871893888e-14 -2.739722021568e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.092648 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937455790916388e-18 } }