{ "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" [ [ 3.3480403 4.6513559 -3.328081 ] [ -0.3552394 0.1099287 -0.5189314 ] [ 0.2995155 0.3864405 -0.4471055 ] [ -0.1777423 -0.3184242 -0.7894977 ] [ 0.4827518 -0.1799787 0.4366547 ] [ 2.8348419 -3.6820154 -2.6651389 ] [ -2.5759403 2.9252695 3.614279 ] [ -3.8562274 -3.8925765 3.6978208 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.364151894156218e-09 7.452293678000144e-09 -5.332173570328686e-09 ] [ -5.691562614670195e-10 1.76125193094937e-10 -8.314197568790132e-10 ] [ 4.798767316672223e-10 6.191459344302624e-10 -7.163419791310944e-10 ] [ -2.847745575872198e-10 -5.101718087369433e-10 -1.264914757115372e-09 ] [ 7.734536476091174e-10 -2.883576653819769e-10 6.995979517024378e-10 ] [ 4.541917415844251e-09 -5.899238991305561e-09 -4.270023236764629e-09 ] [ -4.127111325236538e-09 4.686798402439306e-09 5.790713314848402e-09 ] [ -6.17835738476837e-09 -6.236595062975492e-09 5.924562033667954e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -60.53737 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.69915588987193e-18 } }