{ "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" [ [ 0.1672746 0.2135902 -0.5832693 ] [ -0.1637683 1.1362062 -0.4258627 ] [ -0.3167566 -0.0174388 0.5065806 ] [ 0.5508107 -0.4989187 -0.1416317 ] [ 0.086449 0.4998716 1.9204369 ] [ -0.7478339 0.173198 -0.5378691 ] [ -0.345747 -1.0240251 -1.0860304 ] [ 0.7695715 -0.4824835 0.3476458 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.680034533736717e-10 3.422092248719962e-10 -9.345004360903814e-10 ] [ -2.623857414881606e-10 1.820403010048009e-09 -6.823072616107642e-10 ] [ -5.075000190040972e-10 -2.794003765480704e-11 8.116315938708366e-10 ] [ 8.824960260264825e-10 -7.99355876819929e-10 -2.269189985041594e-10 ] [ 1.385065666915392e-10 8.008825909218893e-10 3.076879102901628e-09 ] [ -1.198161990821685e-09 2.774937863693184e-10 -8.617612970707373e-10 ] [ -5.539477601117377e-10 -1.640669074332382e-09 -1.740012516358072e-09 ] [ 1.232989465333987e-09 -7.730237836217568e-10 5.569899730793127e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 150.38708 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.409466636463793e-17 } }