{ "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" [ [ -5.057550884463841e-10 -2.400099190414961e-09 1.702715126367145e-09 ] [ 1.762098360858138e-09 1.980984686656255e-09 3.906869237581901e-09 ] [ -7.25142895526811e-10 3.362776465864704e-10 -4.73566126458514e-09 ] [ 2.404567981445696e-09 1.450321038939279e-09 -1.898895405095284e-09 ] [ -6.820098655864113e-09 2.102343958063682e-09 3.406204584695123e-09 ] [ -9.476265884916098e-10 1.369785227829836e-09 -1.963053446351585e-09 ] [ 2.275228588725389e-10 2.178767943093504e-11 1.641463753936299e-09 ] [ 4.604433866934881e-09 -4.861400886873834e-09 -2.059642426330796e-09 ] ] "source-value" [ [ -0.3156675 -1.4980241 1.0627512 ] [ 1.0998153 1.2364334 2.438476 ] [ -0.4525986 0.209888 -2.9557673 ] [ 1.5008133 0.9052192 -1.1851973 ] [ -4.2567708 1.3121799 2.1259857 ] [ -0.591462 0.8549527 -1.2252416 ] [ 0.1420086 0.0135988 1.0245211 ] [ 2.8738616 -3.0342478 -1.2855277 ] ] } "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" -5.719690587642622e-18 "source-value" -35.699501 } }