{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.412740000000001e-10 0.0 0.0 ] "source-value" [ 5.41274 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.62551e-13 5.52562e-10 0.0 ] "source-value" [ 0.00162551 5.52562 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.47781e-12 -2.07227e-12 5.37358e-10 ] "source-value" [ 0.0447781 -0.0207227 5.37358 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 8.396182548653089e-10 -1.597653676199482e-09 5.193666843419483e-09 ] [ -6.155634675061536e-10 -3.918882357884659e-10 4.929580231230682e-10 ] [ -3.257953579795878e-09 -3.683282926666668e-09 -2.522333250257345e-09 ] [ 2.820574262560051e-09 2.921117574657058e-09 -1.776440565314554e-10 ] [ -1.933292054314253e-10 -1.45848220621031e-10 -4.129805705659737e-10 ] [ -4.681369426959725e-10 9.799375241856211e-10 -4.886690764180176e-09 ] [ 1.166746351423377e-09 9.505898141517792e-10 2.442923929529986e-09 ] [ -2.919553529839834e-10 9.670281462811874e-10 -1.299001545375879e-10 ] ] "source-value" [ [ 0.5240485 -0.997177 3.2416319 ] [ -0.3842045 -0.2445974 0.3076802 ] [ -2.0334547 -2.2989244 -1.5743166 ] [ 1.760464 1.8232182 -0.1108767 ] [ -0.1206666 -0.0910313 -0.2577622 ] [ -0.2921881 0.6116289 -3.0500325 ] [ 0.7282258 0.5933115 1.5247532 ] [ -0.1822242 0.6035715 -0.0810773 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.91133e-12 1.8955e-12 -1.94937e-11 ] [ 1.34586e-10 1.33293e-10 1.3663e-10 ] [ 9.13327e-12 2.8499e-10 2.77756e-10 ] [ 1.30939e-10 4.04312e-10 4.06983e-10 ] [ 2.74681e-10 -3.01059e-12 2.75341e-10 ] [ 4.03842e-10 1.37613e-10 4.21696e-10 ] [ 2.56627e-10 2.70409e-10 -1.78064e-12 ] [ 4.07687e-10 4.07853e-10 1.33472e-10 ] ] "source-value" [ [ -0.0391133 0.018955 -0.194937 ] [ 1.34586 1.33293 1.3663 ] [ 0.0913327 2.8499 2.77756 ] [ 1.30939 4.04312 4.06983 ] [ 2.74681 -0.0301059 2.75341 ] [ 4.03842 1.37613 4.21696 ] [ 2.56627 2.70409 -0.0178064 ] [ 4.07687 4.07853 1.33472 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.755800764757537e-18 "source-value" -35.924883 } }