{ "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" [ [ 0.0140975 0.5833675 2.011711 ] [ 0.3860738 2.863563 1.325373 ] [ 1.128451 1.622429 0.5509609 ] [ 2.086312 0.6042059 2.517228 ] [ 2.318087 2.883056 0.8671461 ] [ 2.902063 1.818717 2.74846 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.40975e-12 5.833675e-11 2.011711e-10 ] [ 3.860738e-11 2.863563e-10 1.325373e-10 ] [ 1.128451e-10 1.622429e-10 5.509609e-11 ] [ 2.086312e-10 6.042059e-11 2.517228e-10 ] [ 2.318087e-10 2.883056e-10 8.671461e-11 ] [ 2.902063e-10 1.818717e-10 2.74846e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0979407 -2.4230385 2.0225828 ] [ -12.1267472 10.5126861 6.4605517 ] [ 0.5648856 -13.4167504 -11.5272122 ] [ -7.5823668 -18.5286869 -0.8922653 ] [ 11.4569002 7.7735761 -1.5315747 ] [ 12.7852688 16.0822136 5.4679178 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.167801403764785e-09 -3.882135635998301e-09 3.240534875792202e-09 ] [ -1.942919085019186e-08 1.684317989122913e-08 1.03509448912097e-08 ] [ 9.050465017465805e-10 -2.149600381798905e-08 -1.846862988984053e-08 ] [ -1.214829081729011e-08 -2.968622896530323e-08 -1.429566603211098e-09 ] [ 1.835597764727884e-08 1.245464188742964e-08 -2.453853177348773e-09 ] [ 2.048425876200367e-08 2.57665466406318e-08 8.760570063616171e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4800532 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.780013117780227e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1788545 0.8754187 2.4705708 ] [ 0.4555637 3.1397828 1.5311731 ] [ 0.8933224 1.1595493 0.1263854 ] [ 2.4894654 0.3186627 1.8091222 ] [ 2.7661709 2.5830349 0.8697183 ] [ 2.0517076 2.29889 3.2139092 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.788545e-11 8.754187000000001e-11 2.4705708e-10 ] [ 4.555637e-11 3.1397828e-10 1.5311731e-10 ] [ 8.933224e-11 1.1595493e-10 1.263854e-11 ] [ 2.4894654e-10 3.186627e-11 1.8091222e-10 ] [ 2.7661709e-10 2.5830349e-10 8.697183000000001e-11 ] [ 2.0517076e-10 2.29889e-10 3.2139092e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.14e-05 2.3e-06 -1.26e-05 ] [ 9e-07 1.19e-05 -9.4e-06 ] [ 6.9e-06 1.38e-05 2.6e-06 ] [ 1.8e-06 9.4e-06 -7.5e-06 ] [ -4.7e-05 -4.73e-05 4.08e-05 ] [ 6e-06 1e-05 -1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.030834589312e-14 3.68500622784e-15 -2.018742542208e-14 ] [ 1.44195895872e-15 1.906590178752e-14 -1.506046023552e-14 ] [ 1.105501868352e-14 2.211003736704e-14 4.16565921408e-15 ] [ 2.88391791744e-15 1.506046023552e-14 -1.2016324656e-14 ] [ -7.530230117759999e-14 -7.578295416384e-14 6.536880612864e-14 ] [ 9.6130597248e-15 1.6021766208e-14 -2.211003736704e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.568499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.295436822274818e-18 } }