{ "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" [ [ 2.819728 1.352428 1.364201 ] [ 2.130711 2.142985 3.535598 ] [ 2.900765 3.536828 2.247591 ] [ 4.867849 2.542824 1.805581 ] [ 4.180951 2.552465 4.619841 ] [ 3.604443 0.2919785 5.062878 ] [ 4.799237 0.5958561 3.34882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.819728e-10 1.352428e-10 1.364201e-10 ] [ 2.130711e-10 2.142985e-10 3.535598e-10 ] [ 2.900765e-10 3.536828e-10 2.247591e-10 ] [ 4.867849e-10 2.542824e-10 1.805581e-10 ] [ 4.180951e-10 2.552465e-10 4.619841e-10 ] [ 3.604443e-10 2.919785e-11 5.062878e-10 ] [ 4.799237e-10 5.958561e-11 3.34882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4266457 -6.903144 -5.8088654 ] [ -10.9323939 -2.0123416 6.6352656 ] [ -1.5194655 11.7050673 -3.7777115 ] [ 7.9668287 1.1512563 -3.6026846 ] [ 2.7826851 5.738945 6.2356359 ] [ -3.2119687 -4.4941738 5.5889657 ] [ 7.34096 -5.1856093 -5.2706057 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.887915007504851e-09 -1.10600559268158e-08 -9.306828337254041e-09 ] [ -1.751562591595653e-08 -3.224126664583266e-09 1.063086741711848e-08 ] [ -2.434452100212182e-09 1.875358517295058e-08 -6.0525610454273e-09 ] [ 1.276426668505846e-08 1.844515928408711e-09 -5.7721370382362e-09 ] [ 4.45835301026851e-09 9.194803507057056e-09 9.990590054801167e-09 ] [ -5.146141157881369e-09 -7.200460192171896e-09 8.954510178993107e-09 ] [ 1.176151448622797e-08 -8.308261985063055e-09 -8.444441229995218e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.6918892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.392594166682402e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5462533 0.3070389 1.5220571 ] [ 1.7152081 1.7718405 3.2268932 ] [ 2.9895224 3.7591274 2.8133476 ] [ 5.2867154 2.6750571 2.3364821 ] [ 4.5655282 3.1452959 4.7971509 ] [ 3.5207657 0.9841435 4.6771075 ] [ 4.6796908 0.3728613 2.6114716 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5462533e-10 3.070389e-11 1.5220571e-10 ] [ 1.7152081e-10 1.7718405e-10 3.2268932e-10 ] [ 2.9895224e-10 3.7591274e-10 2.8133476e-10 ] [ 5.2867154e-10 2.6750571e-10 2.3364821e-10 ] [ 4.5655282e-10 3.1452959e-10 4.7971509e-10 ] [ 3.5207657e-10 9.841435e-11 4.677107500000001e-10 ] [ 4.6796908e-10 3.728613e-11 2.6114716e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.27e-05 5.8e-06 8e-07 ] [ 4.23e-05 -2.83e-05 -3.32e-05 ] [ -9.3e-06 3.59e-05 1.68e-05 ] [ 1.27e-05 2.43e-05 -7.8e-06 ] [ 8.4e-06 -1.1e-05 -4.73e-05 ] [ -2.93e-05 -3.3e-05 3.82e-05 ] [ 1.79e-05 6.3e-06 3.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.841294170816001e-14 9.292624400640001e-15 1.28174129664e-15 ] [ 6.777207105984e-14 -4.534159836864e-14 -5.319226381056e-14 ] [ -1.490024257344e-14 5.751814068672e-14 2.691656722944e-14 ] [ 2.034764308416e-14 3.893289188544e-14 -1.249697764224e-14 ] [ 1.345828361472e-14 -1.76239428288e-14 -7.578295416384e-14 ] [ -4.694377498944e-14 -5.28718284864e-14 6.120314691456e-14 ] [ 2.867896151232001e-14 1.009371271104e-14 5.223095783807999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }