{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5514237 1.7795588 -0.6418368 ] [ -0.2683775 0.8888517 0.9349535 ] [ -3.7340203 -1.7074011 -0.2125282 ] [ 0.9010083 -1.0087445 1.2364147 ] [ -1.3886805 0.3715718 -0.7416979 ] [ 2.5948493 0.4665597 0.9091718 ] [ 0.3437971 -0.7903963 -1.4844771 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.485654781095033e-09 2.851167504698903e-09 -1.028335915329085e-09 ] [ -4.29988156048752e-10 1.424097413098336e-09 1.497960639235133e-09 ] [ -5.982560026252603e-09 -2.735558124748203e-09 -3.405077133007066e-10 ] [ 1.443574433406753e-09 -1.616186854260585e-09 1.980954725953446e-09 ] [ -2.224911430860854e-09 5.953236509085735e-10 -1.188331035076456e-09 ] [ 4.157406882959245e-09 7.475110435474618e-10 1.456653802250653e-09 ] [ 5.508236759188397e-10 -1.266354473026823e-09 -2.378394503732984e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.29151 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.571493616432941e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4065815 2.1878448 3.1581948 ] [ 3.079225 5.355314 2.8013055 ] [ 2.7393789 3.5754226 1.232167 ] [ 4.496431 2.0189844 1.9964349 ] [ 5.3978749 3.3013755 3.8098791 ] [ 5.0061118 4.4191543 1.7259404 ] [ 3.2476999 3.8473955 4.6040514 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4065815e-10 2.1878448e-10 3.1581948e-10 ] [ 3.079225e-10 5.355314e-10 2.8013055e-10 ] [ 2.7393789e-10 3.5754226e-10 1.232167e-10 ] [ 4.496431000000001e-10 2.0189844e-10 1.9964349e-10 ] [ 5.397874899999999e-10 3.3013755e-10 3.8098791e-10 ] [ 5.006111800000001e-10 4.4191543e-10 1.7259404e-10 ] [ 3.2476999e-10 3.8473955e-10 4.6040514e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.97e-05 1.04e-05 -9.2e-06 ] [ -3.99e-05 3.61e-05 -1.29e-05 ] [ 1.6e-05 -2.97e-05 1.34e-05 ] [ 2.7e-06 1.22e-05 -2.24e-05 ] [ 4.7e-05 -2.39e-05 1.84e-05 ] [ -1.07e-05 -9.2e-06 1.85e-05 ] [ 1.46e-05 4.2e-06 -5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.758464563776e-14 1.666263685632e-14 -1.474002491136e-14 ] [ -6.392684716992e-14 5.783857601088001e-14 -2.066807840832e-14 ] [ 2.56348259328e-14 -4.758464563776e-14 2.146916671872e-14 ] [ 4.32587687616e-15 1.954655477376e-14 -3.588875630592e-14 ] [ 7.530230117759999e-14 -3.829202123712e-14 2.948004982272e-14 ] [ -1.714328984256e-14 -1.474002491136e-14 2.96402674848e-14 ] [ 2.339177866368e-14 6.72914180736e-15 -9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }