{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5795904 0.0105437 0.0349911 ] [ -0.7921269 -0.4544303 0.2172694 ] [ -0.8400278 -0.2057934 0.1529257 ] [ -0.8683812 -0.5961065 0.3483464 ] [ 3.0801263 1.2457865 -0.7535326 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.286061885201203e-10 1.689286963672896e-11 5.606192235607488e-11 ] [ -1.26912719988678e-09 -7.280776024431303e-10 3.481039530952436e-10 ] [ -1.345872901982058e-09 -3.297173741949427e-10 2.450139812594746e-10 ] [ -1.391300056582249e-09 -9.550678978069151e-10 5.581124580198452e-10 ] [ 4.934906346971207e-09 1.995970004808259e-09 -1.207292314730638e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.734777775408901 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.585950256443574e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8426052 3.0007472 1.3941211 ] [ 2.0380753 5.3110664 1.6961171 ] [ 1.9188936 4.0673597 3.6724751 ] [ 3.1119888 2.1251258 3.1516606 ] [ 3.9635941 4.0861869 2.2050842 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8426052e-10 3.0007472e-10 1.3941211e-10 ] [ 2.0380753e-10 5.3110664e-10 1.6961171e-10 ] [ 1.9188936e-10 4.0673597e-10 3.6724751e-10 ] [ 3.1119888e-10 2.1251258e-10 3.1516606e-10 ] [ 3.9635941e-10 4.0861869e-10 2.2050842e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.8e-06 -1.22e-05 -7.1e-06 ] [ 6.6e-06 1.45e-05 4.3e-06 ] [ -2e-06 8.8e-06 5.4e-06 ] [ 8.5e-06 -3.7e-06 5e-07 ] [ -2.09e-05 -7.4e-06 -3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.249697764224e-14 -1.954655477376e-14 -1.137545400768e-14 ] [ 1.057436569728e-14 2.32315610016e-14 6.889359469440001e-15 ] [ -3.2043532416e-15 1.409915426304e-14 8.65175375232e-15 ] [ 1.36185012768e-14 -5.928053496960001e-15 8.010883104e-16 ] [ -3.348549137472e-14 -1.185610699392e-14 -4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.7659997754089005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.238150035698192e-19 } }