{ "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" [ [ 1.992977 1.520628 1.322916 ] [ 2.351443 2.977576 3.35114 ] [ 0.8368319 3.514349 1.69894 ] [ 2.887807 3.844369 0.5466762 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992977e-10 1.520628e-10 1.322916e-10 ] [ 2.351443e-10 2.977576e-10 3.35114e-10 ] [ 8.368319e-11 3.514349e-10 1.69894e-10 ] [ 2.887807e-10 3.844369e-10 5.466762e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1029617 -2.3578822 -0.6602925 ] [ 1.8152059 -0.4005356 2.2034868 ] [ -4.1875715 2.4764608 -0.8350548 ] [ 1.2694038 0.281957 -0.7081396 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.767139449377823e-09 -3.77774373544047e-09 -1.057905206389584e-09 ] [ 2.908280454918223e-09 -6.417287741181005e-10 3.530375035201406e-09 ] [ -6.709229155228387e-09 3.967727596087664e-09 -1.33790527764682e-09 ] [ 2.033809090714679e-09 4.517449134709056e-10 -1.134564711382664e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3352698 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.015022116002029e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9672702 1.5742671 1.4876508 ] [ 1.7293916 2.4873548 3.3370643 ] [ 1.0672589 4.3541933 1.9721852 ] [ 2.3051381 3.4411068 0.1227719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9672702e-10 1.5742671e-10 1.4876508e-10 ] [ 1.7293916e-10 2.4873548e-10 3.3370643e-10 ] [ 1.0672589e-10 4.3541933e-10 1.9721852e-10 ] [ 2.3051381e-10 3.4411068e-10 1.227719e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 8.2e-06 9e-07 ] [ 1.7e-06 -3.1e-06 -8e-07 ] [ 1.9e-06 -1.7e-06 -9e-07 ] [ 1.3e-06 -3.5e-06 9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665441919999e-15 1.313784829056e-14 1.44195895872e-15 ] [ 2.72370025536e-15 -4.96674752448e-15 -1.28174129664e-15 ] [ 3.04413557952e-15 -2.72370025536e-15 -1.44195895872e-15 ] [ 2.08282960704e-15 -5.6076181728e-15 1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.7495813 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.401837460064887e-18 } }