{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9136055 0.1992462 0.0711002 ] [ 0.7203108 0.3740979 2.589381 ] [ 1.027468 2.872573 2.429267 ] [ 2.566191 2.896163 0.5924317 ] [ 2.633567 2.125326 2.686178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.136055e-11 1.992462e-11 7.11002e-12 ] [ 7.203108000000001e-11 3.740979e-11 2.589381e-10 ] [ 1.027468e-10 2.872573e-10 2.429267e-10 ] [ 2.566191e-10 2.896163e-10 5.924317e-11 ] [ 2.633567e-10 2.125326e-10 2.686178e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -17.8826365 6.1865372 3.148967 ] [ 4.4429132 0.0266183 -5.1868003 ] [ 13.4397233 -6.2131555 2.0378333 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -2.865114211856474e-08 9.911925265549495e-09 5.045201307070714e-09 ] [ 7.118331657283714e-09 4.264721794544064e-11 -8.310170177418425e-09 ] [ 2.153281046128102e-08 -9.954572483494934e-09 3.264968870347713e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.3364227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.141185205446412e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9136055 0.1992462 0.0711002 ] [ 0.7203108 0.3740979 2.589381 ] [ 0.500402 2.7368211 3.4180675 ] [ 3.5512854 2.6024712 0.2862856 ] [ 2.1755386 2.5547698 2.0035236 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.136055e-11 1.992462e-11 7.11002e-12 ] [ 7.203108000000001e-11 3.740979e-11 2.589381e-10 ] [ 5.00402e-11 2.7368211e-10 3.4180675e-10 ] [ 3.5512854e-10 2.6024712e-10 2.862856e-11 ] [ 2.1755386e-10 2.5547698e-10 2.0035236e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0482531 0.0028626 0.0474546 ] [ -0.0400828 -0.0042895 0.0582001 ] [ 0.0883359 0.0014269 -0.1056547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -7.730998870112449e-11 4.586390794702081e-12 7.603065066941568e-11 ] [ -6.421972505620225e-11 -6.8725366149216e-12 9.324683954822207e-11 ] [ 1.415297137573267e-10 2.28614582021952e-12 -1.692774902176378e-10 ] ] } "relaxed-potential-energy" { "source-value" -5.6515847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.054836876810982e-19 } }