{ "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" [ 5.52208 0 0 ] "si-unit" "m" "si-value" [ 5.52208e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968577 5.45697 0 ] "si-unit" "m" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.137264 0.147448 5.57607 ] "si-unit" "m" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2344156 0.398202 -0.9908719 ] [ 1.2101339 -1.2895163 -0.9300115 ] [ -1.658065 1.5089449 0.9123572 ] [ -2.5287155 3.1076063 -2.1076083 ] [ -0.8576609 -0.616876 -0.2366454 ] [ 2.9632262 -1.7084389 -0.6261357 ] [ 0.1975372 -1.3664008 2.5171829 ] [ 0.9079596 -0.0335211 1.4617327 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.755751938708045e-10 6.379899347558017e-10 -1.587551792387676e-09 ] [ 1.938848242617525e-09 -2.066032868000519e-09 -1.490042682375139e-09 ] [ -2.656512978766752e-09 2.417596240855394e-09 1.46175737565855e-09 ] [ -4.051448854754582e-09 4.978934160510791e-09 -3.376760744064033e-09 ] [ -1.374124242554287e-09 -9.883443051326208e-10 -3.791477272998644e-10 ] [ 4.747611739782025e-09 -2.737220863645269e-09 -1.003179979988243e-09 ] [ 3.164894835782938e-10 -2.189215416402417e-09 4.032971592657544e-09 ] [ 1.45471164375092e-09 -5.370672272349888e-11 2.34195395779886e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.139288 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.790152232595799e-18 } }