{ "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" [ 5.47042 0 0 ] "si-unit" "m" "si-value" [ 5.47042e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0146058 5.3888 0 ] "si-unit" "m" "si-value" [ 1.46058e-12 5.3888e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.134413 -0.103851 5.39218 ] "si-unit" "m" "si-value" [ 1.34413e-11 -1.03851e-11 5.39218e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2547312 -0.9112326 0.6157232 ] [ 0.7697281 0.7198194 1.8195256 ] [ -0.3480579 0.1625269 -2.2560524 ] [ 1.1553326 0.730162 -0.9243719 ] [ -2.8305437 0.5782785 1.1886849 ] [ -0.2872894 0.5544172 -0.7248717 ] [ 0.077798 -0.0312382 0.64176 ] [ 1.7177633 -1.8027332 -0.3603977 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.08124373228329e-10 -1.459955567830798e-09 9.864973159241626e-10 ] [ 1.233240366192805e-09 1.153277813878283e-09 2.915201377267092e-09 ] [ -5.576502300647443e-10 2.603967994310995e-10 -3.61459441057973e-09 ] [ 1.851046880968078e-09 1.16984848579657e-09 -1.481007047104475e-09 ] [ -4.535030940292729e-09 9.265042930112928e-10 1.904483156277986e-09 ] [ -4.602883600836595e-10 8.882742760093978e-10 -1.161372490819551e-09 ] [ 1.246461367449984e-10 -5.004911371587457e-11 1.028212868164608e-09 ] [ 2.752160199328257e-09 -2.888296986579971e-09 -5.774207691300922e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -23.011301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.686816847639166e-18 } }