{ "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" [ 5.45404 0 0 ] "si-unit" "m" "si-value" [ 5.45404e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00269758 5.32364 0 ] "si-unit" "m" "si-value" [ 2.69758e-13 5.32364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0264471 0.0433477 5.27221 ] "si-unit" "m" "si-value" [ -2.64471e-12 4.33477e-12 5.272210000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0265045 0.0366931 0.0259636 ] [ 1.48655 1.36127 1.37402 ] [ -0.0176096 2.76119 2.70854 ] [ 1.17184 4.14313 4.05378 ] [ 2.72197 0.0231604 2.74475 ] [ 4.08411 1.50063 4.06205 ] [ 2.69936 2.73466 -0.181062 ] [ 4.07246 4.14715 1.4277 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.65045e-12 3.66931e-12 2.59636e-12 ] [ 1.48655e-10 1.36127e-10 1.37402e-10 ] [ -1.76096e-12 2.76119e-10 2.70854e-10 ] [ 1.17184e-10 4.14313e-10 4.05378e-10 ] [ 2.72197e-10 2.31604e-12 2.74475e-10 ] [ 4.08411e-10 1.50063e-10 4.06205e-10 ] [ 2.69936e-10 2.73466e-10 -1.81062e-11 ] [ 4.07246e-10 4.14715e-10 1.4277e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6962015 1.6672456 2.0587651 ] [ -1.4251029 1.1784977 -0.4572872 ] [ 0.2885734 -0.6079061 -1.0793606 ] [ 1.4846714 -0.7245229 -1.9428548 ] [ 0.0974178 1.3029705 0.887496 ] [ 0.297262 -1.7052542 -1.8623292 ] [ 0.806485 1.5462832 4.7762785 ] [ -0.8531052 -2.6573138 -2.3807079 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.115437775855751e-09 2.67122194345931e-09 3.298505338114673e-09 ] [ -2.283266567425639e-09 1.888161478162742e-09 -7.326548668672848e-10 ] [ 4.623455586739355e-10 -9.739729490860674e-10 -1.72932633298022e-09 ] [ 2.378705826248067e-09 -1.160813661177918e-09 -3.112796563814743e-09 ] [ 1.560805228956852e-10 2.087588889891297e-09 1.421925353968464e-09 ] [ 4.762662305761079e-10 -2.732118434270362e-09 -2.983780329055913e-09 ] [ 1.29213142267149e-09 2.477418812586749e-09 7.652441810176568e-09 ] [ -1.366825217783897e-09 -4.257486079565749e-09 -3.814314569759208e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.807552 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.737002313513997e-18 } }