{ "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" [ [ 0.223645 0.1945873 1.126976 ] [ 0.7288277 2.388611 0.0814776 ] [ 2.404153 0.5300895 0.5572584 ] [ 2.145602 0.6403931 2.690423 ] [ 2.26761 2.998114 1.480003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.23645e-11 1.945873e-11 1.126976e-10 ] [ 7.288277e-11 2.388611e-10 8.14776e-12 ] [ 2.404153e-10 5.300895e-11 5.572584000000001e-11 ] [ 2.145602e-10 6.403931000000001e-11 2.690423e-10 ] [ 2.26761e-10 2.998114e-10 1.480003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4263378 0.5265051 0.2895114 ] [ -1.1705535 -1.3238048 -0.8284163 ] [ 0.9506875 0.7658755 -2.3077105 ] [ -0.5890758 0.9360269 1.3983729 ] [ 1.2352796 -0.9046027 1.4482425 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.830684557233063e-10 8.43554161951966e-10 4.638483965350771e-10 ] [ -1.875433451095613e-09 -2.12096910106282e-09 -1.327269228149639e-09 ] [ 1.5231692861868e-09 1.227067820543511e-09 -3.697359810674679e-09 ] [ -9.438034746390567e-10 1.4996804156199e-09 2.240440367540296e-09 ] [ 1.979136095271176e-09 -1.449333297052556e-09 2.320340274748944e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.443382 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.474302558648355e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2431552 0.2296714 1.216698 ] [ 0.6452681 2.2686434 0.0443968 ] [ 2.5000353 0.6797458 0.3453511 ] [ 1.9896311 0.7673824 2.7509986 ] [ 2.3917479 2.8063519 1.5786935 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.431552e-11 2.296714e-11 1.216698e-10 ] [ 6.452681e-11 2.2686434e-10 4.43968e-12 ] [ 2.5000353e-10 6.797457999999999e-11 3.453511000000001e-11 ] [ 1.9896311e-10 7.673824e-11 2.7509986e-10 ] [ 2.3917479e-10 2.8063519e-10 1.5786935e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.84e-05 2.15e-05 7e-07 ] [ 1.41e-05 -1.99e-05 2.25e-05 ] [ -9.6e-06 1.3e-06 7.8e-06 ] [ -8.3e-06 1.57e-05 -3.44e-05 ] [ -1.46e-05 -1.87e-05 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.948004982272e-14 3.44467973472e-14 1.12152363456e-15 ] [ 2.259069035328e-14 -3.188331475392e-14 3.604897396800001e-14 ] [ -1.538089555968e-14 2.08282960704e-15 1.249697764224e-14 ] [ -1.329806595264e-14 2.515417294656e-14 -5.511487575552001e-14 ] [ -2.339177866368e-14 -2.996070280896e-14 5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }