{ "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" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0085846 -6.1231081 -2.216085 ] [ -3.3451988 -4.1740077 2.6759722 ] [ -0.4353259 -0.2125534 1.9723021 ] [ 0.1010827 7.999018 -4.6178941 ] [ 0.1379994 -3.572088 -1.0072997 ] [ 5.6768057 5.3961379 -0.8964968 ] [ 2.8732215 0.6866012 4.0895014 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.024637149418919e-09 -9.81030064445111e-09 -3.550559576705568e-09 ] [ -5.359599309288214e-09 -6.68749755197918e-09 4.287380096750742e-09 ] [ -6.974689794087187e-10 -3.405480881515507e-10 3.159976313774744e-09 ] [ 1.619523387073402e-10 1.281583962895838e-08 -7.398681964350257e-09 ] [ 2.210994123644275e-10 -5.72311588104023e-09 -1.613872029478854e-09 ] [ 9.095245373364179e-09 8.645565985992809e-09 -1.436346213582014e-09 ] [ 4.603408313679908e-09 1.100056390453225e-09 6.552103533808869e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.382769 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.6635029750967e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9698807 0.8956907 2.1806446 ] [ 0.7639148 0.7336528 4.4044393 ] [ 2.2810817 2.7418846 4.904179 ] [ 2.3869034 3.3060606 2.5394889 ] [ 4.2906792 0.6235222 2.8596601 ] [ 4.8539249 2.9919438 2.0485687 ] [ 4.1811003 1.3446878 5.1120755 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9698807e-10 8.956907e-11 2.1806446e-10 ] [ 7.639148000000001e-11 7.336528e-11 4.4044393e-10 ] [ 2.2810817e-10 2.7418846e-10 4.904179e-10 ] [ 2.3869034e-10 3.3060606e-10 2.5394889e-10 ] [ 4.2906792e-10 6.235222e-11 2.8596601e-10 ] [ 4.8539249e-10 2.9919438e-10 2.0485687e-10 ] [ 4.1811003e-10 1.3446878e-10 5.112075500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.1e-06 3.7e-06 2.32e-05 ] [ 5.5e-06 -5.4e-06 -7.7e-06 ] [ -9.3e-06 1.43e-05 -1.31e-05 ] [ -3e-07 5.4e-06 1.5e-06 ] [ 9.3e-06 -4.3e-06 -1.7e-06 ] [ -2.1e-06 2.4e-06 -9e-07 ] [ 1e-06 -1.6e-05 -1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.568924145279999e-15 5.928053496960001e-15 3.717049760256e-14 ] [ 8.8119714144e-15 -8.65175375232e-15 -1.233675998016e-14 ] [ -1.490024257344e-14 2.291112567744e-14 -2.098851373248e-14 ] [ -4.8065298624e-16 8.65175375232e-15 2.4032649312e-15 ] [ 1.490024257344e-14 -6.889359469440001e-15 -2.72370025536e-15 ] [ -3.36457090368e-15 3.84522388992e-15 -1.44195895872e-15 ] [ 1.6021766208e-15 -2.56348259328e-14 -2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.978138 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.040632900991607e-18 } }