{ "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" [ [ -1.2341872 1.0814884 -0.6394318 ] [ -0.2352922 -4.0607361 4.731528 ] [ 0.7772154 -0.6786567 0.6678468 ] [ 0.692264 3.6579043 -4.759943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.977385893821885e-09 1.732735444422045e-09 -1.024482688996561e-09 ] [ -3.769796650024548e-10 -6.506016496260286e-09 7.580743604716752e-09 ] [ 1.245236353464963e-09 -1.087327907247548e-09 1.070008538051671e-09 ] [ 1.109129205359376e-09 5.860608798868125e-09 -7.626269453771861e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4589863 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.515496683118611e-18 } "relaxed-configuration-positions" { "source-value" [ [ 5.3581463 2.9458853 2.4985355 ] [ 3.2548088 1.8814808 2.6962868 ] [ 5.0650274 5.1235561 1.6222228 ] [ 3.4760164 3.4933848 0.9790439 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.3581463e-10 2.9458853e-10 2.4985355e-10 ] [ 3.2548088e-10 1.8814808e-10 2.6962868e-10 ] [ 5.065027400000001e-10 5.123556100000001e-10 1.6222228e-10 ] [ 3.4760164e-10 3.4933848e-10 9.790439000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 4.3e-06 1e-06 ] [ 2.2e-06 5e-07 -1e-06 ] [ -3.2e-06 -1.05e-05 -3e-07 ] [ 1.1e-06 5.7e-06 3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-16 6.8893595262e-15 1.602176634e-15 ] [ 3.5247885948e-15 8.010883169999999e-16 -1.602176634e-15 ] [ -5.1269652288e-15 -1.6822854657e-14 -4.806529901999999e-16 ] [ 1.7623942974e-15 9.1324068138e-15 4.806529901999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.547084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689829154163525e-18 } }