{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47042e-10 0.0 0.0 ] "source-value" [ 5.47042 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.46058e-12 5.3888e-10 0.0 ] "source-value" [ 0.0146058 5.3888 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.34413e-11 -1.03851e-11 5.39218e-10 ] "source-value" [ 0.134413 -0.103851 5.39218 ] } "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" [ [ -4.241831497162694e-10 -1.546115980185222e-09 1.056971137419658e-09 ] [ 1.319184324485758e-09 1.244181470118586e-09 3.056823376397777e-09 ] [ -5.624163850763002e-10 2.589530780780967e-10 -3.834096773288544e-09 ] [ 1.883232366232681e-09 1.175241412302182e-09 -1.492140572442415e-09 ] [ -4.788527325235704e-09 9.050585180712365e-10 2.040099396345602e-09 ] [ -4.268691988210407e-10 9.885605989764289e-10 -1.292220973698991e-09 ] [ 1.627641616010995e-10 -1.097523028780416e-10 1.086479385550904e-09 ] [ 2.836815206529776e-09 -2.916126954700928e-09 -6.219149762839911e-10 ] ] "source-value" [ [ -0.2647543 -0.9650097 0.6597095 ] [ 0.8233701 0.776557 1.9079191 ] [ -0.3510327 0.1616258 -2.393055 ] [ 1.1754212 0.733528 -0.9313209 ] [ -2.9887637 0.5648931 1.2733299 ] [ -0.2664308 0.617011 -0.8065409 ] [ 0.1015894 -0.068502 0.6781271 ] [ 1.7706008 -1.8201033 -0.3881688 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -8.13222e-12 6.58783e-12 -1.48119e-12 ] [ 1.29496e-10 1.3028e-10 1.25678e-10 ] [ 7.31236e-13 2.63688e-10 2.91411e-10 ] [ 1.38293e-10 3.97853e-10 4.11798e-10 ] [ 2.91023e-10 -2.59257e-14 2.64672e-10 ] [ 4.15592e-10 1.24599e-10 4.16086e-10 ] [ 2.63613e-10 2.74458e-10 -9.27687e-13 ] [ 4.0418e-10 4.10114e-10 1.35651e-10 ] ] "source-value" [ [ -0.0813222 0.0658783 -0.0148119 ] [ 1.29496 1.3028 1.25678 ] [ 0.00731236 2.63688 2.91411 ] [ 1.38293 3.97853 4.11798 ] [ 2.91023 -0.000259257 2.64672 ] [ 4.15592 1.24599 4.16086 ] [ 2.63613 2.74458 -0.00927687 ] [ 4.0418 4.10114 1.35651 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.324572063520021e-18 "source-value" -26.991856 } }