{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.7980136 -7.7942658 0.3828498 ] [ -14.0833679 14.6286923 -3.942223 ] [ -6.1354645 4.7998504 9.8746272 ] [ 10.5639322 -15.4612769 -18.4261581 ] [ 18.4529139 3.8270001 12.110904 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.409597169940044e-08 -1.248779044106101e-08 6.133929988379559e-10 ] [ -2.256404279150519e-08 2.343774879593698e-08 -6.316137524580038e-09 ] [ -9.830097779648363e-09 7.69020809421753e-09 1.582089683895577e-08 ] [ 1.692528519455631e-08 -2.47716963768951e-08 -2.952195971898455e-08 ] [ 2.956482723621535e-08 6.131530088019262e-09 1.94038072455532e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.6505283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.065532095822877e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4941535 1.7587799 2.2600413 ] [ 2.7866988 4.3077873 1.0245894 ] [ 2.4984901 4.0351379 3.6757514 ] [ 4.266709 2.1945018 0.2968148 ] [ 4.8669445 3.2778911 2.6742187 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4941535e-10 1.7587799e-10 2.2600413e-10 ] [ 2.7866988e-10 4.3077873e-10 1.0245894e-10 ] [ 2.4984901e-10 4.0351379e-10 3.6757514e-10 ] [ 4.266709e-10 2.1945018e-10 2.968148e-11 ] [ 4.8669445e-10 3.2778911e-10 2.6742187e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-06 -4.6e-06 1.4e-06 ] [ 1.11e-05 1.2e-06 4.4e-06 ] [ 8.3e-06 -2.8e-06 -7e-06 ] [ -4.2e-06 5.4e-06 1.19e-05 ] [ -2.22e-05 7e-07 -1.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-14 -7.370012455680001e-15 2.24304726912e-15 ] [ 1.778416049088e-14 1.92261194496e-15 7.04957713152e-15 ] [ 1.329806595264e-14 -4.48609453824e-15 -1.12152363456e-14 ] [ -6.72914180736e-15 8.65175375232e-15 1.906590178752e-14 ] [ -3.556832098176e-14 1.12152363456e-15 -1.714328984256e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.907624 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.548682326527698e-18 } }