{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47042e-10 0.0 0.0 ] "source-value" [ 5.47042 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.46058e-12 5.3888e-10 0.0 ] "source-value" [ 0.0146058 5.3888 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.34413e-11 -1.03851e-11 5.39218e-10 ] "source-value" [ 0.134413 -0.103851 5.39218 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.590543776552135e-10 -1.761313935184595e-09 1.359448464925421e-09 ] [ 1.358722678916198e-09 1.265371057016976e-09 4.886129681927572e-09 ] [ -1.392175005234868e-09 1.102550338581162e-09 -6.525429375902157e-09 ] [ 3.458714801918208e-09 2.766169151047546e-09 -3.330771225469941e-09 ] [ -7.252338190500413e-09 2.43058204258464e-11 2.400525209178432e-09 ] [ -2.617618539120212e-10 9.722461150998086e-10 -1.372774248533601e-09 ] [ 2.375039385671366e-10 1.063034574841075e-10 1.533353521876915e-09 ] [ 4.410387847683311e-09 -4.47563184425319e-09 1.049517971997358e-09 ] ] "source-value" [ [ -0.3489343 -1.0993257 0.848501 ] [ 0.848048 0.7897825 3.0496823 ] [ -0.8689273 0.6881578 -4.0728527 ] [ 2.15876 1.726507 -2.0789039 ] [ -4.5265535 0.0151705 1.49829 ] [ -0.1633789 0.6068283 -0.8568183 ] [ 0.1482383 0.0663494 0.957044 ] [ 2.7527476 -2.7934697 0.6550576 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.72594276146997e-18 "source-value" -35.738524 } }