{ "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 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0681259 5.43851 0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00252152 -0.017859 5.5414 ] } "unrelaxed-configuration-positions" { "source-unit" "angstrom" "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-configuration-forces" { "source-unit" "eV/angstrom" "source-value" [ [ -0.340145 -0.187333 -1.648227 ] [ 0.379884 0.05646 -0.304683 ] [ 0.418815 2.069906 -2.743198 ] [ -0.458651 -0.195486 3.076801 ] [ 0.731985 0.042292 -1.691741 ] [ -1.239737 -1.611297 3.892007 ] [ -0.325969 -0.105234 -1.37759 ] [ 0.833819 -0.069308 0.796632 ] ] } "unrelaxed-potential-energy" { "source-unit" "eV" "source-value" -35.174163 } }