{ "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" [ [ -0.2998409 -1.2216278 0.7881558 ] [ 0.9514527 0.9002245 2.2502142 ] [ -0.3056501 0.1511748 -2.769031 ] [ 1.379941 0.8765508 -1.0004412 ] [ -3.7142641 1.2375956 1.9678239 ] [ -0.6170935 0.656571 -0.9214062 ] [ 0.2843574 0.015213 0.7980614 ] [ 2.3210975 -2.6157019 -1.1133769 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.803980799396307e-10 -1.957263500479338e-09 1.26276479630792e-09 ] [ 1.524395271737036e-09 1.44231864737137e-09 3.605240583032175e-09 ] [ -4.89705444365182e-10 2.422087302141158e-10 -4.436476730470445e-09 ] [ 2.210909208283373e-09 1.404389198703537e-09 -1.602883501125097e-09 ] [ -5.950907104496753e-09 1.982846736324948e-09 3.152801446431477e-09 ] [ -9.886927785476448e-10 1.051942706095277e-09 -1.476255471900169e-09 ] [ 4.555907782314739e-10 2.43739129322304e-11 1.278635317042917e-09 ] [ 3.718808149097328e-09 -4.19081643116214e-09 -1.783826439318779e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.837574 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.741812320898994e-18 } }