{ "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" [ [ -0.2664566 -1.0819777 0.7591762 ] [ 1.0370956 0.8572809 2.2435278 ] [ -0.3392704 0.2016865 -2.6938483 ] [ 1.5212148 0.8172386 -1.1189436 ] [ -3.4058052 0.9377503 1.494206 ] [ -0.6460376 0.6082238 -0.8208218 ] [ 0.1021481 0.0735548 0.7659109 ] [ 1.9971114 -2.4137571 -0.6292071 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.269105349778572e-10 -1.733519375166956e-09 1.216334358707785e-09 ] [ 1.661610323854549e-09 1.373515415438383e-09 3.594527789274858e-09 ] [ -5.435711030094644e-10 3.231373950309792e-10 -4.316020766241825e-09 ] [ 2.437254787774948e-09 1.309360578535323e-09 -1.792745275913787e-09 ] [ -5.456701466439069e-09 1.502441606808186e-09 2.393981919859085e-09 ] [ -1.035066338877742e-09 9.74481952574135e-10 -1.315101497802974e-09 ] [ 1.636592976791405e-10 1.178477809076199e-10 1.227124537595887e-09 ] [ 3.199725194213157e-09 -3.867265193910009e-09 -1.008100905261368e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.699435 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.719680013276925e-18 } }