{ "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" [ [ -0.1919867 -1.0542732 0.7563081 ] [ 0.8933722 0.8107928 1.7965394 ] [ -0.2527057 0.1291906 -2.1141136 ] [ 1.0578704 0.5999098 -0.8677319 ] [ -2.9234733 0.9221481 1.3276923 ] [ -0.5295346 0.642723 -0.9160682 ] [ 0.1166832 0.0259548 0.7381872 ] [ 1.8297744 -2.0764458 -0.7208133 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.075966047787678e-10 -1.689131886892408e-09 1.211739165924935e-09 ] [ 1.431340064305175e-09 1.299033279175435e-09 2.878373448740379e-09 ] [ -4.048791678186138e-10 2.069861606524403e-10 -3.387183411541622e-09 ] [ 1.694895236680234e-09 9.611614640676132e-10 -1.390259774756425e-09 ] [ -4.683920611382872e-09 1.477444138907495e-09 2.127197580201718e-09 ] [ -8.484079630145362e-10 1.029755772734382e-09 -1.467703065190439e-09 ] [ 1.869470966203488e-10 4.15841741001432e-11 1.182706283357885e-09 ] [ 2.93162178917137e-09 -3.326832942527437e-09 -1.154870226736432e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.079138 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.780515187846149e-18 } }