{ "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" [ [ 2.114 2.095272 1.915779 ] [ 2.14246 0.9228837 3.956719 ] [ 3.791491 3.03012 0.940196 ] [ 4.524648 0.3016751 5.057567 ] [ 3.666195 2.4276 3.537085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.114e-10 2.095272e-10 1.915779e-10 ] [ 2.14246e-10 9.228837e-11 3.956719e-10 ] [ 3.791491000000001e-10 3.03012e-10 9.40196e-11 ] [ 4.524648e-10 3.016751e-11 5.057567e-10 ] [ 3.666195e-10 2.4276e-10 3.537085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9038547 -0.7799479 -1.9305005 ] [ -2.7855771 -3.5610726 2.1492671 ] [ 2.1901716 1.3705421 -1.9857941 ] [ 0.0 0.0 0.0 ] [ 4.4992601 2.9704784 1.7670274 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.254664782871079e-09 -1.249614301117369e-09 -3.093002793025317e-09 ] [ -4.462986541825481e-09 -5.705467311697628e-09 3.443505527844941e-09 ] [ 3.509041761970394e-09 2.195850528533291e-09 -3.181592906955059e-09 ] [ 0.0 0.0 0.0 ] [ 7.208609402508503e-09 4.759231084281705e-09 2.831090011917771e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.6368995 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.031308667106282e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8320073 2.0696752 1.3379282 ] [ 1.9004284 1.5456712 3.5714447 ] [ 3.4711725 3.1213354 0.1234466 ] [ 5.3434166 0.2496346 5.3893449 ] [ 3.6917693 1.7912345 4.9851817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8320073e-10 2.0696752e-10 1.3379282e-10 ] [ 1.9004284e-10 1.5456712e-10 3.5714447e-10 ] [ 3.4711725e-10 3.1213354e-10 1.234466e-11 ] [ 5.343416600000001e-10 2.496346e-11 5.389344900000001e-10 ] [ 3.6917693e-10 1.7912345e-10 4.985181700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.6e-06 -2.7e-06 -2e-07 ] [ 3.6e-06 2.4e-06 -5.3e-06 ] [ 2.1e-06 4e-07 2.1e-06 ] [ -4e-07 0.0 -3e-07 ] [ 1.5e-06 -1e-07 3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.05743657844e-14 -4.3258769118e-15 -3.204353268e-16 ] [ 5.767835882399999e-15 3.845223921599999e-15 -8.4915361602e-15 ] [ 3.364570931399999e-15 6.408706536e-16 3.364570931399999e-15 ] [ -6.408706536e-16 0.0 -4.806529901999999e-16 ] [ 2.403264951e-15 -1.602176634e-16 5.9280535458e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.663724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.708516942422502e-18 } }