{ "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" [ [ 1.5439384 3.0507888 -0.4615628 ] [ -0.9424787 -0.7726043 -0.9493425 ] [ 0.3810966 0.2880244 -0.6647713 ] [ -0.1634911 -0.1849771 -1.2817534 ] [ 1.6834387 -0.1311498 0.4195705 ] [ 0.2620778 -2.9904776 -1.4464928 ] [ -0.32568 0.9902197 2.2275059 ] [ -2.4389018 -0.2498242 2.1568463 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.473662028815345e-09 4.887902530628898e-09 -7.395051332836151e-10 ] [ -1.510017351182696e-09 -1.237848556787926e-09 -1.521014371163145e-09 ] [ 6.105840678168442e-10 4.614659637018696e-10 -1.065081043813804e-09 ] [ -2.619416202869574e-10 -2.963659874450814e-10 -2.053595348030055e-09 ] [ 2.697166149911335e-09 -2.101251451137732e-10 6.722260514156969e-10 ] [ 4.198949274501252e-10 -4.791273335220398e-09 -2.317536965409235e-09 ] [ -5.2179688616112e-10 1.58650686586649e-09 3.56885790507714e-09 ] [ -3.907551476580541e-09 -4.002624958477428e-10 3.455648744989354e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.25477 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.808654536504418e-18 } }