{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.317023 1.146232 2.35214 ] [ 1.137751 1.512768 4.697187 ] [ 2.525224 3.828296 5.439775 ] [ 1.195151 3.273987 3.261847 ] [ 3.958209 2.788765 2.245111 ] [ 4.201729 2.884975 4.427405 ] [ 3.756146 4.818354 3.421856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.317023e-10 1.146232e-10 2.35214e-10 ] [ 1.137751e-10 1.512768e-10 4.697187e-10 ] [ 2.525224e-10 3.828296e-10 5.439775e-10 ] [ 1.195151e-10 3.273987e-10 3.261847e-10 ] [ 3.958209e-10 2.788765e-10 2.245111e-10 ] [ 4.201729000000001e-10 2.884975e-10 4.427405e-10 ] [ 3.756146e-10 4.818354e-10 3.421856e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3070669 0.9947668 0.861611 ] [ 0.722467 -0.2380906 0.1670824 ] [ -2.8905446 -0.1671038 0.077487 ] [ 1.8205317 1.3775111 -0.1866756 ] [ -0.8669641 -1.3997202 -2.8797144 ] [ 3.3937257 -3.5885873 3.2206489 ] [ -1.8721488 3.021224 -1.2604393 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.919754082015315e-10 1.593792110108029e-09 1.380453000424109e-09 ] [ 1.157519736699513e-09 -3.814631929522445e-10 2.676955150271539e-10 ] [ -4.631162979499688e-09 -2.67729801606839e-10 1.241478598159296e-10 ] [ 2.916813327165279e-09 2.207016079312491e-09 -2.990872819938125e-10 ] [ -1.389029612092913e-09 -2.2425989801015e-09 -4.6138110862611e-09 ] [ 5.437347973948115e-09 -5.749550673759795e-09 5.160048371385237e-09 ] [ -2.999513038018775e-09 4.84053445899986e-09 -2.019446378397518e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.566291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.974647737516945e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9267535 1.6380355 2.5460773 ] [ 1.573936 1.6806775 4.8254006 ] [ 2.8802776 3.4677555 5.4745815 ] [ 1.0128595 3.739485 2.2183511 ] [ 4.0499357 2.6660393 2.6150087 ] [ 4.8476891 2.4739643 4.7672117 ] [ 2.7997815 4.5874198 3.3986901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9267535e-10 1.6380355e-10 2.5460773e-10 ] [ 1.573936e-10 1.6806775e-10 4.8254006e-10 ] [ 2.8802776e-10 3.4677555e-10 5.4745815e-10 ] [ 1.0128595e-10 3.739485e-10 2.2183511e-10 ] [ 4.0499357e-10 2.6660393e-10 2.6150087e-10 ] [ 4.847689100000001e-10 2.4739643e-10 4.7672117e-10 ] [ 2.7997815e-10 4.5874198e-10 3.3986901e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-05 -1.42e-05 -2.5e-06 ] [ -7.7e-06 -1.8e-06 -2.4e-06 ] [ 9.2e-06 -1e-05 -1.9e-06 ] [ 1.33e-05 6.1e-06 -4e-06 ] [ 7.4e-06 -1.01e-05 3.2e-06 ] [ 2.8e-06 2.42e-05 -4.3e-06 ] [ -4.9e-06 5.8e-06 1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-14 -2.275090801536e-14 -4.005441552e-15 ] [ -1.233675998016e-14 -2.88391791744e-15 -3.84522388992e-15 ] [ 1.474002491136e-14 -1.6021766208e-14 -3.04413557952e-15 ] [ 2.130894905664e-14 9.77327738688e-15 -6.4087064832e-15 ] [ 1.185610699392e-14 -1.618198387008e-14 5.126965186560001e-15 ] [ 4.48609453824e-15 3.877267422336e-14 -6.889359469440001e-15 ] [ -7.850665441919999e-15 9.292624400640001e-15 1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.544009 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.611948415890479e-18 } }