{ "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" [ [ 15.0513102 -35.1692259 54.2068289 ] [ 44.8779645 -59.0083925 87.3756947 ] [ 23.8737633 17.9245409 12.037585 ] [ -83.803038 76.2530774 -153.6201086 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.411485731484857e-08 -5.634731150861384e-08 8.684891395128578e-08 ] [ 7.190242551099236e-08 -9.454186689449008e-08 1.399912952744985e-07 ] [ 3.824998540977305e-08 2.871828036855339e-08 1.928633725789277e-08 ] [ -1.34267268235614e-07 1.221708978743328e-07 -2.461265464836771e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 42.345153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.784441414079899e-18 } "relaxed-configuration-positions" { "source-value" [ [ 5.8538325 2.9031188 3.1933838 ] [ 3.3295758 1.6404496 2.522054 ] [ 5.247459 5.0816624 1.375929 ] [ 2.7231317 3.8190762 0.7047222 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.8538325e-10 2.9031188e-10 3.1933838e-10 ] [ 3.3295758e-10 1.6404496e-10 2.522054e-10 ] [ 5.247459e-10 5.0816624e-10 1.375929e-10 ] [ 2.7231317e-10 3.8190762e-10 7.047222e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.47e-05 -2e-05 -4.9e-06 ] [ -4.3e-06 1.85e-05 1.82e-05 ] [ 3.7e-06 1.69e-05 2.4e-05 ] [ -2.42e-05 -1.54e-05 -3.74e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.957376253376001e-14 -3.2043532416e-14 -7.850665441919999e-15 ] [ -6.889359469440001e-15 2.96402674848e-14 2.915961449856e-14 ] [ 5.928053496960001e-15 2.707678489152e-14 3.84522388992e-14 ] [ -3.877267422336e-14 -2.467351996032e-14 -5.992140561792e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.3275482 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.494437965542512e-18 } }