{ "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" [ [ 1.463501 2.539158 2.160753 ] [ 0.2382428 1.617471 2.877509 ] [ 1.691566 0.7573037 1.355751 ] [ 1.857 2.738979 0.0220673 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.463501e-10 2.539158e-10 2.160753e-10 ] [ 2.382428e-11 1.617471e-10 2.877509e-10 ] [ 1.691566e-10 7.573037e-11 1.355751e-10 ] [ 1.857e-10 2.738979e-10 2.20673e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 18.9909492 24.4854363 -4.3116461 ] [ -21.453201 -14.7836358 12.5220498 ] [ 2.2101066 -9.6069149 -5.3097893 ] [ 0.2521453 -0.0948857 -2.9006144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.042685481504046e-08 3.922999358994766e-08 -6.9080185785835e-09 ] [ -3.437181708352318e-08 -2.368599564918191e-08 2.006253543405332e-08 ] [ 3.540981123995777e-09 -1.539197445079517e-08 -8.507220277833999e-09 ] [ 4.039813047046023e-10 -1.520236501882426e-10 -4.647296577635819e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.1225039 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.400626126136821e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5950237 2.9874787 2.2242595 ] [ 0.1274358 1.3208676 3.0395344 ] [ 1.5269164 0.7160633 1.2307348 ] [ 2.0009338 2.6285021 -0.0784483 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5950237e-10 2.9874787e-10 2.2242595e-10 ] [ 1.274358e-11 1.3208676e-10 3.0395344e-10 ] [ 1.5269164e-10 7.160633e-11 1.2307348e-10 ] [ 2.0009338e-10 2.6285021e-10 -7.84483e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.59e-05 1.5e-05 5e-07 ] [ -1.78e-05 -4.4e-06 -1.31e-05 ] [ 7.7e-06 -3.29e-05 2.07e-05 ] [ -1.59e-05 2.23e-05 -8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.149637447872e-14 2.4032649312e-14 8.010883104e-16 ] [ -2.851874385024e-14 -7.04957713152e-15 -2.098851373248e-14 ] [ 1.233675998016e-14 -5.271161082432e-14 3.316505605055999e-14 ] [ -2.547460827072e-14 3.572853864384e-14 -1.297763062848e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.547071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689827057411768e-18 } }