{ "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" [ [ 0.0251564 0.6941165 0.4465085 ] [ 0.3172663 0.1337315 1.61278 ] [ 0.5869901 2.638721 0.7880578 ] [ 2.963349 2.149596 1.324349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.51564e-12 6.941165e-11 4.465085e-11 ] [ 3.172663e-11 1.337315e-11 1.61278e-10 ] [ 5.869901e-11 2.638721e-10 7.880578e-11 ] [ 2.963349e-10 2.149596e-10 1.324349e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7528937 10.2969812 -22.1840584 ] [ 5.6113994 -12.0922246 22.6186998 ] [ 1.3883611 1.6841025 -0.2499508 ] [ -1.2468667 0.1111408 -0.1846906 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.217151788087611e-09 1.649758254345713e-08 -3.554277972294186e-08 ] [ 8.990452928651148e-09 -1.937387954758263e-08 3.623915201245364e-08 ] [ 2.224399695648171e-09 2.698229652530832e-09 -4.004653281102567e-10 ] [ -1.997700675994047e-09 1.780671913770086e-10 -2.959069614015245e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 3.500364 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.608201365089971e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.4084726 0.9190139 0.2634507 ] [ 1.1178775 -0.1018516 1.7234975 ] [ 0.8285216 2.9099234 0.3623232 ] [ 2.3548353 1.8890794 1.8224239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.084726e-11 9.190139000000001e-11 2.634507e-11 ] [ 1.1178775e-10 -1.018516e-11 1.7234975e-10 ] [ 8.285216e-11 2.9099234e-10 3.623232e-11 ] [ 2.3548353e-10 1.8890794e-10 1.8224239e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.58e-05 2.7e-06 -9.6e-06 ] [ -1.3e-06 2.34e-05 9.6e-06 ] [ -9.4e-06 -9.3e-06 1.65e-05 ] [ -5.1e-06 -1.69e-05 -1.66e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.531439060864e-14 4.32587687616e-15 -1.538089555968e-14 ] [ -2.08282960704e-15 3.749093292672001e-14 1.538089555968e-14 ] [ -1.506046023552e-14 -1.490024257344e-14 2.64359142432e-14 ] [ -8.17110076608e-15 -2.707678489152e-14 -2.659613190528e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.4643956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.195928011872239e-18 } }