{ "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" [ [ -0.4176479 -1.3796082 0.8926836 ] [ 1.1693269 1.0370167 2.7955272 ] [ -0.5622408 0.2563697 -3.4480894 ] [ 1.8488078 1.21071 -1.4296384 ] [ -4.3403985 1.0364821 1.8935442 ] [ -0.5577188 0.7567866 -0.9904343 ] [ 0.1623436 0.0110157 0.943659 ] [ 2.6975279 -2.9287726 -0.657252 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.691457011062163e-10 -2.210376003903971e-09 1.430236793691579e-09 ] [ 1.873468221252539e-09 1.661483912119167e-09 4.478928322650486e-09 ] [ -9.008090650198886e-10 4.107495396215097e-10 -5.5244482231083e-09 ] [ 2.962116633512682e-09 1.939771256568768e-09 -2.290533220677919e-09 ] [ -6.954085001655389e-09 1.660627388497688e-09 3.033792247691439e-09 ] [ -8.93564022340631e-10 1.212505797454721e-09 -1.586850679898413e-09 ] [ 2.601031204565069e-10 1.764909700174656e-11 1.511908387807507e-09 ] [ 4.32191613533572e-09 -4.69241098735963e-09 -1.053033788374041e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.625075 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.707766227924657e-18 } }