{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.51396 0 0 ] "si-unit" "m" "si-value" [ 5.51396e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0181329 5.46551 0 ] "si-unit" "m" "si-value" [ 1.81329e-12 5.46551e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.147171 -0.00272143 5.46493 ] "si-unit" "m" "si-value" [ 1.47171e-11 -2.72143e-13 5.46493e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0812176 -0.117418 -0.0378641 ] [ 1.41633 1.35692 1.32004 ] [ 0.0825096 2.73802 2.72856 ] [ 1.5042 4.09281 4.08646 ] [ 2.79856 -0.0135645 2.62504 ] [ 4.22175 1.43085 4.07963 ] [ 2.7526 2.68069 -0.168753 ] [ 4.2604 4.00574 1.18537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.12176e-12 -1.17418e-11 -3.78641e-12 ] [ 1.41633e-10 1.35692e-10 1.32004e-10 ] [ 8.25096e-12 2.73802e-10 2.72856e-10 ] [ 1.5042e-10 4.09281e-10 4.08646e-10 ] [ 2.79856e-10 -1.35645e-12 2.62504e-10 ] [ 4.22175e-10 1.43085e-10 4.07963e-10 ] [ 2.7526e-10 2.68069e-10 -1.68753e-11 ] [ 4.2604e-10 4.00574e-10 1.18537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3995746 2.7467889 -0.9433302 ] [ -0.5722245 -0.2960957 -0.5474112 ] [ 0.3560455 0.3895177 -0.4347415 ] [ -0.0450711 -0.0166412 -0.8995208 ] [ 0.9845514 -0.1449885 0.2449513 ] [ 0.9077184 -2.5345135 -1.3946827 ] [ -0.966132 1.1676905 2.0121317 ] [ -2.0644623 -1.3117582 1.9626034 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.242365721659896e-09 4.400840994110562e-09 -1.511381604586547e-09 ] [ -9.16804723302333e-10 -4.743976119678738e-10 -8.770494338299007e-10 ] [ 5.704477807408469e-10 6.240761574694217e-10 -6.96532673130111e-10 ] [ -7.22118632886774e-11 -2.666214180172079e-11 -1.441191207556987e-09 ] [ 1.577425248051987e-09 -2.32297186898709e-10 3.924552493279242e-10 ] [ 1.454325210731865e-09 -4.060738308257559e-09 -2.234528033784031e-09 ] [ -1.547914115759688e-09 1.870846434843777e-09 3.223790394270697e-09 ] [ -3.307633258833898e-09 -2.101668337497899e-09 3.144437309288955e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.260963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.809646764493853e-18 } }