{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.453455 0.6257932 -0.2541735 ] [ -0.545007 1.1574401 -1.2590673 ] [ 0.1246117 0.001298 0.7422273 ] [ 0.1152048 -0.5162406 -0.5001634 ] [ 0.7258761 0.6120872 3.1870511 ] [ -1.3735727 0.3734226 -0.7007834 ] [ -0.6214155 -0.9808563 -1.1507386 ] [ 1.1208476 -1.2729442 -0.0643522 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.265149995848641e-10 1.002631234495619e-09 -4.072308393269088e-10 ] [ -8.731974735723457e-10 1.854423468196414e-09 -2.01724819207378e-09 ] [ 1.996499524181434e-10 2.0796252537984e-12 1.189179227379508e-09 ] [ 1.845784371639398e-10 -8.271086200277646e-10 -8.013501060598388e-10 ] [ 1.162981717017483e-09 9.806718017309338e-10 5.106218761714924e-09 ] [ -2.200706066909132e-09 5.982889593983501e-10 -1.122778779724735e-09 ] [ -9.956173859027425e-10 -1.571505032224391e-09 -1.843686481572123e-09 ] [ 1.79579582019979e-09 -2.039481436822959e-09 -1.031035903370458e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.421205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.835320315236407e-18 } }