{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.274506 0.3236661 2.677073 ] [ 0.5953025 1.868691 3.011541 ] [ 2.644287 1.363154 4.648241 ] [ 2.19861 3.39541 3.518323 ] [ 4.456442 1.578463 3.034766 ] [ 3.361859 3.152961 1.75355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.274506e-10 3.236661e-11 2.677073e-10 ] [ 5.953025e-11 1.868691e-10 3.011541e-10 ] [ 2.644287e-10 1.363154e-10 4.648241e-10 ] [ 2.19861e-10 3.39541e-10 3.518323e-10 ] [ 4.456442e-10 1.578463e-10 3.034766e-10 ] [ 3.361859e-10 3.152961e-10 1.75355e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.933713 -6.7209839 -3.5309169 ] [ -5.6625502 0.5326232 -2.1625652 ] [ 2.384424 -1.069048 7.118475 ] [ -3.3788056 7.6390568 2.6346628 ] [ 5.8382182 -1.9008704 -1.1107453 ] [ 1.7524266 1.5192223 -2.9489105 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.49597313913703e-09 -1.076820327335321e-08 -5.657152507167611e-09 ] [ -9.072405544546365e-09 8.533564387356825e-10 -3.464811404395676e-09 ] [ 3.82026838687442e-09 -1.712803712112998e-09 1.140505422074928e-08 ] [ -5.413443338548117e-09 1.223911820992326e-08 4.221195141851466e-09 ] [ 9.353856707169058e-09 -3.045530114050745e-09 -1.779610151323482e-09 ] [ 2.807696928188033e-09 2.434062450858004e-09 -4.724675459931638e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.3652355 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.596054883186199e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1409665 0.0739949 2.2403438 ] [ 0.5189432 1.7081598 2.7607957 ] [ 3.2682905 2.0075701 5.0358037 ] [ 1.853405 3.4284005 3.6652213 ] [ 4.1259154 1.1388955 2.9360307 ] [ 3.6234859 3.3253243 2.0052988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1409665e-10 7.399490000000001e-12 2.2403438e-10 ] [ 5.189432000000001e-11 1.7081598e-10 2.7607957e-10 ] [ 3.2682905e-10 2.0075701e-10 5.0358037e-10 ] [ 1.853405e-10 3.4284005e-10 3.6652213e-10 ] [ 4.125915400000001e-10 1.1388955e-10 2.9360307e-10 ] [ 3.6234859e-10 3.3253243e-10 2.0052988e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.32e-05 2e-07 -6.3e-06 ] [ -1.15e-05 -3.3e-06 2.7e-06 ] [ 3.2e-06 -4e-07 -1.1e-06 ] [ 1.19e-05 -1.5e-06 -1e-07 ] [ -2.16e-05 1.46e-05 4.5e-06 ] [ 4.9e-06 -9.7e-06 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.114873139456e-14 3.2043532416e-16 -1.009371271104e-14 ] [ -1.84250311392e-14 -5.28718284864e-15 4.32587687616e-15 ] [ 5.126965186560001e-15 -6.408706483200001e-16 -1.76239428288e-15 ] [ 1.906590178752e-14 -2.4032649312e-15 -1.6021766208e-16 ] [ -3.460701500928e-14 2.339177866368e-14 7.2097947936e-15 ] [ 7.850665441919999e-15 -1.554111322176e-14 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -9.5540646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53072989357329e-18 } }