{ "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" [ [ -0.2814142 -0.2074906 -1.6531785 ] [ 0.4991867 0.0803653 -0.0359815 ] [ 0.7465237 2.0972881 -2.9633617 ] [ -0.4604745 -0.3563274 3.0881926 ] [ 0.7469109 0.2265774 -1.9409757 ] [ -1.5073928 -1.6828586 3.8448122 ] [ -0.4760481 -0.2363773 -1.471817 ] [ 0.7327083 0.0788231 1.1323097 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.508752520011354e-10 -3.324365883557644e-10 -2.648683942709213e-09 ] [ 7.997852601543034e-10 1.287594047835782e-10 -5.76487180813152e-11 ] [ 1.196062819013113e-09 3.360225960902053e-09 -4.747828834714144e-09 ] [ -7.377614783745696e-10 -5.7089942963045e-10 4.947829984247566e-09 ] [ 1.196683181800687e-09 3.6301701308165e-10 -3.109785888080914e-09 ] [ -2.41510950252225e-09 -2.696236705032219e-09 6.160068218206614e-09 ] [ -7.627131361962605e-10 -3.787181837478278e-10 -2.358110787495993e-09 ] [ 1.173928108126113e-09 1.262885279989805e-10 1.814160128845062e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.760604 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.729480367448697e-18 } }