{ "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" [ [ 1.3812728 -2.3238354 2.0694724 ] [ 2.4580083 3.7762043 -5.7003078 ] [ 0.9131444 -0.2363812 5.4678948 ] [ -1.9371328 -5.4459198 2.6765813 ] [ 3.015218 4.4338959 5.3659217 ] [ -3.3787716 2.5060199 -4.2175865 ] [ -1.6315565 -0.8956864 1.674342 ] [ -0.8201826 -1.8142972 -7.3363179 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.213042987106954e-09 -3.723194748467416e-09 3.315660296670866e-09 ] [ 3.938163431992353e-09 6.050146244824429e-09 -9.132899888523882e-09 ] [ 1.463018609094444e-09 -3.78724432236649e-10 8.760533213553892e-09 ] [ -3.103628883544842e-09 -8.725325382311813e-09 4.288355982530471e-09 ] [ 4.830911786215334e-09 7.103884350040973e-09 8.597154296783393e-09 ] [ -5.413388864543009e-09 4.015086495039554e-09 -6.7573184865017e-09 ] [ -2.614041679814275e-09 -1.435047809648517e-09 2.682591607623513e-09 ] [ -1.314077386506958e-09 -2.906824557022902e-09 -1.175407702213655e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -18.356932 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.941104728001539e-18 } }