{ "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" [ [ 5.517305 2.823831 2.520754 ] [ 3.206819 2.056835 2.580452 ] [ 4.931014 5.152147 1.608787 ] [ 3.498861 3.411494 1.086096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.517305000000001e-10 2.823831e-10 2.520754e-10 ] [ 3.206819e-10 2.056835e-10 2.580452e-10 ] [ 4.931014e-10 5.152147000000001e-10 1.608787e-10 ] [ 3.498861e-10 3.411494e-10 1.086096e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.0784741 -0.3979357 1.6423531 ] [ -1.2382477 -2.6742863 2.7327197 ] [ 0.4787394 0.5054098 0.2091108 ] [ -2.3189658 2.5668121 -4.5841836 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.932259230758321e-09 -6.375632751216826e-10 2.631339739918405e-09 ] [ -1.983891515699372e-09 -4.284678987185735e-09 4.37829961453959e-09 ] [ 7.670250741358195e-10 8.097557654832039e-10 3.350324349167847e-10 ] [ -3.715392789194769e-09 4.112486336606551e-09 -7.344671789374779e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.5539465 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.296226614673988e-19 } "relaxed-configuration-positions" { "source-value" [ [ 5.5306931 2.9887047 2.9235793 ] [ 3.526652 2.0020582 2.400819 ] [ 5.0503464 4.7200966 1.4972274 ] [ 3.0463075 3.7334476 0.9744632 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.5306931e-10 2.9887047e-10 2.9235793e-10 ] [ 3.526652e-10 2.0020582e-10 2.400819e-10 ] [ 5.0503464e-10 4.7200966e-10 1.4972274e-10 ] [ 3.0463075e-10 3.7334476e-10 9.744632e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.1e-06 3.7e-06 -5e-06 ] [ 1.1e-06 1e-06 -2.3e-06 ] [ 1e-07 -2.7e-06 -4e-07 ] [ 7e-06 -2e-06 7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.297763062848e-14 5.928053496960001e-15 -8.010883104e-15 ] [ 1.76239428288e-15 1.6021766208e-15 -3.68500622784e-15 ] [ 1.6021766208e-16 -4.32587687616e-15 -6.408706483200001e-16 ] [ 1.12152363456e-14 -3.2043532416e-15 1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.5960346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.056801242610788e-18 } }