{ "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" [ [ 0.0137593 -1.1947963 0.7411684 ] [ 0.6118228 0.9286337 2.3269203 ] [ 1.007692 -0.943411 -1.5428276 ] [ -0.0490261 -0.1102995 0.0228386 ] [ -2.0887854 2.2459704 0.9523542 ] [ -1.0249851 0.5750425 -0.9111536 ] [ 0.5931041 0.0751765 0.7172316 ] [ 0.9364183 -1.5763163 -2.306532 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.20448289601962e-11 -1.914274714249654e-09 1.187482692339165e-09 ] [ 9.80248194308455e-10 1.487835215684966e-09 3.728137333840269e-09 ] [ 1.614500576668728e-09 -1.511511060458574e-09 -2.471882331010298e-09 ] [ -7.85484718761474e-11 -1.76719281641883e-10 3.659147127327239e-11 ] [ -3.346603161320343e-09 3.598441295535633e-09 1.525839646531763e-09 ] [ -1.642207177418154e-09 9.21319657056945e-10 -1.459829007904982e-09 ] [ 9.502575305495994e-10 1.20446031725901e-10 1.149131710686434e-09 ] [ 1.500307519910002e-09 -2.525537143653334e-09 -3.695471675973287e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.381856 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.18814530487527e-18 } }