{ "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" [ [ -0.2181823 -0.9609472 0.5997932 ] [ 0.8468149 0.6842044 1.9351432 ] [ -0.2810515 0.1458287 -2.300715 ] [ 1.2338346 0.7331593 -0.8986021 ] [ -3.0072055 1.0528032 1.5296692 ] [ -0.5943203 0.522107 -0.6921503 ] [ 0.1591384 0.040101 0.5849237 ] [ 1.8609718 -2.2172564 -0.7580618 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.495665801323718e-10 -1.539607137663222e-09 9.609746423548186e-10 ] [ 1.35674703492509e-09 1.096216293528492e-09 3.100441192940098e-09 ] [ -4.502941425407712e-10 2.33643333781657e-10 -3.686151784123872e-09 ] [ 1.97682095005412e-09 1.174650689782093e-09 -1.439719276021784e-09 ] [ -4.818074346041174e-09 1.686776673343426e-09 2.450800229797839e-09 ] [ -9.522060899268422e-10 8.365076289560256e-10 -1.108947028739706e-09 ] [ 2.549678239515188e-10 6.42488846707008e-11 9.37151077091833e-10 ] [ 2.981605509928093e-09 -3.552436366399174e-09 -1.214548893081566e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.031584 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.772896149519135e-18 } }