{ "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" [ 5.44188 0 0 ] "si-unit" "m" "si-value" [ 5.44188e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0681259 5.43851 0 ] "si-unit" "m" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00252152 -0.017859 5.5414 ] "si-unit" "m" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00431502 -0.0137584 0.0307734 ] [ 1.33409 1.32426 1.37744 ] [ 0.0396224 2.60036 2.83022 ] [ 1.35045 4.04355 3.98016 ] [ 2.67673 0.013858 2.80413 ] [ 4.08887 1.41719 3.918 ] [ 2.72143 2.70354 0.017408 ] [ 3.9766 4.07774 1.36794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.31502e-13 -1.37584e-12 3.07734e-12 ] [ 1.33409e-10 1.32426e-10 1.37744e-10 ] [ 3.962240000000001e-12 2.60036e-10 2.83022e-10 ] [ 1.35045e-10 4.04355e-10 3.98016e-10 ] [ 2.67673e-10 1.3858e-12 2.80413e-10 ] [ 4.08887e-10 1.41719e-10 3.918e-10 ] [ 2.72143e-10 2.70354e-10 1.7408e-12 ] [ 3.9766e-10 4.077740000000001e-10 1.36794e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3777446 0.052631 -2.2763732 ] [ 0.4353465 0.0354723 0.0229928 ] [ -0.4255209 2.0357468 -2.9390243 ] [ -0.4402654 -0.0992319 3.4503603 ] [ 0.6623248 -0.067784 -1.9917756 ] [ -0.5778139 -1.5462349 4.2084931 ] [ -0.4142895 -0.0126874 -1.7441055 ] [ 1.137963 -0.397912 1.2694324 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.052135717396762e-10 8.4324158424054e-11 -3.647151951303809e-09 ] [ 6.97501989993681e-10 5.683289021423819e-11 3.68385269102352e-11 ] [ -6.817596432586505e-10 3.261625955700271e-09 -4.708836060218206e-09 ] [ -7.053829366386634e-10 -1.589870315274246e-10 5.52808665154123e-09 ] [ 1.061161318678723e-09 -1.08601940959056e-10 -3.19117632649133e-09 ] [ -9.257599293804125e-10 -2.477341427455327e-09 6.742749309170225e-09 ] [ -6.637649566115429e-10 -2.03274558262116e-11 -2.794365079330887e-09 ] [ 1.823217728956542e-09 -6.37525308788208e-10 2.033854929722541e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.29229329230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.494231103920356e-18 } }