{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7418446 -8.4290957 2.1075366 ] [ -7.8546781 3.3838241 2.3479899 ] [ 8.493646 -5.1443975 -2.2926108 ] [ -3.5367225 -0.6477714 -9.2006433 ] [ 3.0894599 1.1373461 8.5312472 ] [ 2.5501395 9.7000943 -1.4935196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.392919315986728e-09 -1.350490006502581e-08 3.376645868000321e-09 ] [ -1.258458161572977e-08 5.421483861919602e-09 3.761894523654529e-09 ] [ 1.360832104655144e-08 -8.242233402601968e-09 -3.673167424353585e-09 ] [ -5.666454103757328e-09 -1.037844192702885e-09 -1.474105559158016e-08 ] [ 4.949860422679107e-09 1.822229331178059e-09 1.366856481010546e-08 ] [ 4.085773886678601e-09 1.554126430701534e-08 -2.392882185826568e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 47.615558 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.628853381394641e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8678426 -2.2042114 4.6311549 ] [ -1.0394011 4.5409688 4.9012946 ] [ 8.1814621 0.5290339 2.0446364 ] [ 1.9341683 2.1903549 -1.4597066 ] [ 5.441394 3.1599056 8.3483761 ] [ 5.3225671 7.4576222 2.3869995 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8678426e-10 -2.2042114e-10 4.631154900000001e-10 ] [ -1.0394011e-10 4.5409688e-10 4.9012946e-10 ] [ 8.1814621e-10 5.290339e-11 2.0446364e-10 ] [ 1.9341683e-10 2.1903549e-10 -1.4597066e-10 ] [ 5.441394e-10 3.1599056e-10 8.3483761e-10 ] [ 5.3225671e-10 7.457622200000001e-10 2.3869995e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ -0.0 -0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.846037335159101e-34 } }