{ "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" [ 5.42333 0 0 ] "si-unit" "m" "si-value" [ 5.423330000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0707092 5.40512 0 ] "si-unit" "m" "si-value" [ 7.07092e-12 5.40512e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00203562 -0.0726392 5.50089 ] "si-unit" "m" "si-value" [ -2.03562e-13 -7.26392e-12 5.50089e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00542909 0.0277818 -0.0388963 ] [ 1.35422 1.36306 1.38504 ] [ 0.0297601 2.72434 2.72311 ] [ 1.36125 4.06894 4.03995 ] [ 2.72846 0.00923744 2.71344 ] [ 4.08711 1.36473 3.96445 ] [ 2.72619 2.69674 -0.100972 ] [ 4.11061 4.07011 1.39355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.42909e-13 2.77818e-12 -3.88963e-12 ] [ 1.35422e-10 1.36306e-10 1.38504e-10 ] [ 2.97601e-12 2.72434e-10 2.72311e-10 ] [ 1.36125e-10 4.06894e-10 4.03995e-10 ] [ 2.72846e-10 9.23744e-13 2.71344e-10 ] [ 4.08711e-10 1.36473e-10 3.96445e-10 ] [ 2.72619e-10 2.69674e-10 -1.00972e-11 ] [ 4.11061e-10 4.07011e-10 1.39355e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5171553 0.3996451 0.0735384 ] [ 0.3069506 0.0306401 -0.8150863 ] [ -0.0225834 0.0486202 -0.3579434 ] [ 0.7437814 -0.2671186 0.4712063 ] [ -0.6122839 -0.07457 -0.0771998 ] [ 0.2161782 -0.4571859 1.3305043 ] [ -0.1044924 0.5702865 0.5699004 ] [ -0.0103953 -0.2503174 -1.1949199 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.285741309828103e-10 6.403020358372781e-10 1.178215052110387e-10 ] [ 4.917890750605325e-10 4.909085187897408e-11 -1.305912213794375e-09 ] [ -3.618259549817472e-11 7.789814773862017e-11 -5.734885470496628e-10 ] [ 1.191669170065893e-09 -4.279711759008269e-10 7.549557174336711e-10 ] [ -9.809869498722453e-10 -1.19474310613056e-10 -1.236877146904358e-10 ] [ 3.463556579666266e-10 -7.324925603394067e-10 2.13170288333387e-09 ] [ -1.674152803312819e-10 9.136996974578592e-10 9.130810970645683e-10 ] [ -1.665510662620224e-11 -4.01052686059442e-10 -1.914472727508674e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.480041 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.601699612482546e-18 } }