{ "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" [ [ -0.3508449 -1.5293913 1.0012109 ] [ 1.1849533 1.2709302 2.4480971 ] [ 0.0665159 -0.3112768 -2.4687182 ] [ 1.0604418 0.3808682 -0.7735535 ] [ -3.5852169 1.4196263 1.5671241 ] [ -0.4872771 0.9547084 -1.3047133 ] [ 0.0539411 -0.0444558 0.9945051 ] [ 2.0574868 -2.1410093 -1.4639521 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.621154963069139e-10 -2.450354984914919e-09 1.604116696470127e-09 ] [ 1.898504473999809e-09 2.036254653108668e-09 3.92228393906828e-09 ] [ 1.065702198914707e-10 -4.987204115574375e-10 -3.955322583383458e-09 ] [ 1.699015059679069e-09 6.102181256461785e-10 -1.239369332638013e-09 ] [ -5.744150697677052e-09 2.274492068132807e-09 2.510809594912241e-09 ] [ -7.807039774712237e-10 1.529611478161375e-09 -2.090381146106817e-09 ] [ 8.642316932023488e-11 -7.122604341896063e-11 1.593372820486366e-09 ] [ 3.296457248564605e-09 -3.430275045375373e-09 -2.345509828591064e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.666111 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.874558581985771e-18 } }