{ "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" [ [ 4.4711207 -3.0183404 -7.1090622 ] [ 6.4774346 2.1959146 8.5343051 ] [ -0.2376333 -3.3305405 -0.5507914 ] [ 0.4357969 0.7158356 -0.0195763 ] [ -12.6120964 2.5456247 -1.5189262 ] [ 7.8035051 3.7124992 -5.0495348 ] [ -7.0944054 4.0138056 2.8645608 ] [ 0.7562778 -6.8347987 2.8490249 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.163525054314931e-09 -4.83591442249612e-09 -1.138997325265301e-08 ] [ 1.0377994278881e-08 3.518243033393384e-09 1.367346410599421e-08 ] [ -3.807305175835527e-10 -5.336114123727542e-09 -8.824651040177012e-10 ] [ 6.982236045971156e-10 1.146895062656341e-09 -3.136469018176704e-11 ] [ -2.020680599135585e-08 4.078540379671014e-09 -2.433588046360585e-09 ] [ 1.250259343151357e-08 5.948079422978704e-09 -8.090246602476004e-09 ] [ -1.136649047035727e-08 6.430825492756118e-09 4.589532342620144e-09 ] [ 1.211690609990058e-09 -1.095055468501423e-08 4.564641086857058e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.285223 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.288745031351444e-18 } }