{ "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" [ [ 1.6970504 -1.9882913 -3.0728695 ] [ -1.0630895 -1.3758453 1.0720584 ] [ 1.5048601 1.3878009 -0.3943079 ] [ -1.9156865 1.7939846 2.4165115 ] [ -1.4555818 0.903915 -0.2090002 ] [ 1.889849 -1.3016728 0.1979978 ] [ -0.6574017 0.580109 -0.0103901 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.718974475199288e-09 -3.185593836200039e-09 -4.923279671669386e-09 ] [ -1.703257142717961e-09 -2.204347173497562e-09 1.717626904612255e-09 ] [ 2.41105166979475e-09 2.223502156305199e-09 -6.317508987767443e-10 ] [ -3.06926812308218e-09 2.87428018419524e-09 3.87167822919434e-09 ] [ -2.332099129621981e-09 1.448231480190432e-09 -3.348552341825242e-10 ] [ 3.027871884642259e-09 -2.085509728091274e-09 3.172274461298343e-10 ] [ -1.053273634214175e-09 9.294370773156672e-10 -1.664677530777408e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -29.276071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.690543650508088e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2602789 1.2433619 1.7100492 ] [ 1.750463 0.7924299 4.0452322 ] [ 2.0066914 2.7634701 5.2741718 ] [ 2.2792548 3.2958519 3.0151401 ] [ 3.9122388 0.1332774 3.1460245 ] [ 4.3827429 2.3607833 2.2294593 ] [ 4.1358151 2.0482681 4.628979 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2602789e-10 1.2433619e-10 1.7100492e-10 ] [ 1.750463e-10 7.924299000000001e-11 4.0452322e-10 ] [ 2.0066914e-10 2.7634701e-10 5.274171800000001e-10 ] [ 2.2792548e-10 3.2958519e-10 3.0151401e-10 ] [ 3.9122388e-10 1.332774e-11 3.1460245e-10 ] [ 4.382742900000001e-10 2.3607833e-10 2.2294593e-10 ] [ 4.1358151e-10 2.0482681e-10 4.628979e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.24e-05 1.46e-05 5.68e-05 ] [ 7.1e-06 -2.03e-05 -2.68e-05 ] [ 1.89e-05 -1.62e-05 -2.14e-05 ] [ -3.78e-05 3.59e-05 -3.45e-05 ] [ -2.47e-05 -1.68e-05 1.72e-05 ] [ 1e-06 1.02e-05 1.43e-05 ] [ 2.3e-05 -7.5e-06 -5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.986699009792e-14 2.339177866368e-14 9.100363206143999e-14 ] [ 1.137545400768e-14 -3.252418540224e-14 -4.293833343744e-14 ] [ 3.028113813312e-14 -2.595526125696e-14 -3.428657968511999e-14 ] [ -6.056227626623999e-14 5.751814068672e-14 -5.52750934176e-14 ] [ -3.957376253376001e-14 -2.691656722944e-14 2.755743787776e-14 ] [ 1.6021766208e-15 1.634220153216e-14 2.291112567744e-14 ] [ 3.68500622784e-14 -1.2016324656e-14 -8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -32.25324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.16753870730514e-18 } }