{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44188e-10 0.0 0.0 ] "source-value" [ 5.44188 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] "source-value" [ -0.0681259 5.43851 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] "source-value" [ -0.00252152 -0.017859 5.5414 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.193657471252306e-09 7.675275167241025e-11 -6.958358166920724e-09 ] [ 1.782671910845831e-09 7.275647457068122e-10 1.708719603688917e-09 ] [ 5.496222357144342e-09 1.058395872979704e-08 -1.639933002349254e-08 ] [ -2.075453506313161e-09 -1.623214641790063e-09 1.230469097313573e-08 ] [ 3.073386037432959e-09 1.497510748040012e-09 -9.277344121772107e-09 ] [ -8.640397364214108e-09 -9.460869608460856e-09 1.899965226490291e-08 ] [ -1.746169520894145e-09 -1.523068829712676e-09 -6.11826038059281e-09 ] [ 3.303397557250587e-09 -2.786338952526797e-10 5.740229530615305e-09 ] ] "source-value" [ [ -0.7450224 0.0479053 -4.3430656 ] [ 1.1126563 0.4541102 1.0664989 ] [ 3.4304722 6.6059875 -10.2356568 ] [ -1.2953962 -1.0131309 7.6799841 ] [ 1.9182567 0.9346727 -5.7904628 ] [ -5.3929119 -5.9050104 11.8586503 ] [ -1.0898733 -0.9506248 -3.8187178 ] [ 2.0618186 -0.1739096 3.5827695 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.447959029490012e-18 "source-value" -34.003486 } }