{ "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" [ [ -0.1933055 -1.0793202 0.7745352 ] [ 0.91124 0.8901758 2.3469594 ] [ -0.1646265 0.1649276 -2.8434839 ] [ 1.3157183 0.7377161 -1.0273177 ] [ -3.2628128 0.8113944 1.4326709 ] [ -0.6436382 0.5445608 -0.9206654 ] [ 0.3082233 0.0830723 0.8308657 ] [ 1.7292013 -2.1525269 -0.5935641 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.097095527720544e-10 -1.72926159079718e-09 1.240942189426652e-09 ] [ 1.459967423937792e-09 1.426218855161937e-09 3.760243480646795e-09 ] [ -2.637607294641312e-10 2.642431448446541e-10 -4.555763426201205e-09 ] [ 2.108013099818721e-09 1.181951488207755e-09 -1.645944401074028e-09 ] [ -5.227602386206986e-09 1.299997137928043e-09 2.295391821280495e-09 ] [ -1.031222076293795e-09 8.724825823641445e-10 -1.47506857945948e-09 ] [ 4.938281652458247e-10 1.330964968960839e-10 1.331193599564627e-09 ] [ 2.770485895516967e-09 -3.448728274823099e-09 -9.509945239661934e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.871204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.747200440874744e-18 } }