{ "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" [ [ 0.6340785 3.1397425 -0.4952767 ] [ -0.7252529 -0.4132328 -0.6451337 ] [ 0.2355601 0.4963418 -0.3304926 ] [ 0.5884554 0.7563061 -0.8005627 ] [ 1.50926 -0.3747127 -0.2222032 ] [ 0.9831447 -2.8823735 -1.2150517 ] [ -1.3869637 0.636224 1.6347854 ] [ -1.8382821 -1.3582955 2.0739353 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.015905748451933e-09 5.030422028832144e-09 -7.935207495669754e-10 ] [ -1.1619832405474e-09 -6.620719311077222e-10 -1.033618131430201e-09 ] [ 3.7740888501331e-10 7.952272278857894e-10 -5.295075170674062e-10 ] [ 9.428094842635124e-10 1.211735951588427e-09 -1.282642841424524e-09 ] [ 2.418101086708608e-09 -6.003559274568442e-10 -3.560087721069465e-10 ] [ 1.57517145320343e-09 -4.618071434113469e-09 -1.946727426803295e-09 ] [ -2.222160814038265e-09 1.019343218391859e-09 2.619214947905176e-09 ] [ -2.945252603055128e-09 -2.176229294237847e-09 3.322810650711835e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -216.41617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.467369279370783e-17 } }