{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.513446e-11 2.4971467e-10 1.3825914e-10 ] [ 2.094899e-10 1.0431376e-10 4.766485e-11 ] [ 2.4794643e-10 2.1180908e-10 2.5580748e-10 ] ] "source-value" [ [ 0.4513446 2.4971467 1.3825914 ] [ 2.094899 1.0431376 0.4766485 ] [ 2.4794643 2.1180908 2.5580748 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.65793236720384e-12 2.3904475182336e-13 1.850513997024e-12 ] [ 5.022823706207999e-13 -1.49066512799232e-12 -1.97259985552896e-12 ] [ -2.16021473782464e-12 1.25178059383104e-12 1.2224607616704e-13 ] ] "source-value" [ [ 0.0010348 0.0001492 0.001155 ] [ 0.0003135 -0.0009304 -0.0012312 ] [ -0.0013483 0.0007813 7.63e-05 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.031763483817495e-18 "source-value" -6.4397612 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.33452883461438e-08 2.507793978076571e-09 -7.712859507064737e-09 ] [ 2.682556359737856e-11 -6.002971275748608e-11 -7.361024244837314e-11 ] [ 1.331846278254642e-08 -2.447764425536748e-09 7.786469909730771e-09 ] ] "source-value" [ [ -8.3294739 1.5652419 -4.8139883 ] [ 0.0167432 -0.0374676 -0.0459439 ] [ 8.3127307 -1.5277744 4.8599323 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -7.983742392261311e-19 "source-value" -4.9830601 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.208619e-11 2.499094e-10 1.535343e-10 ] [ 2.130892e-10 9.677261000000001e-11 3.862007e-11 ] [ 2.273954e-10 2.191555e-10 2.495771e-10 ] ] "source-value" [ [ 0.6208619 2.499094 1.535343 ] [ 2.130892 0.9677261 0.3862007 ] [ 2.273954 2.191555 2.495771 ] ] } "instance-id" 1 }