{ "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" [ [ -0.2984219 -0.1662404 -1.2780206 ] [ 0.3158732 0.0710925 -0.2597497 ] [ 0.3490679 1.9800917 -2.8943566 ] [ -0.4910754 -0.1483811 3.0202615 ] [ 0.7457644 0.0079897 -1.9639481 ] [ -1.1070795 -1.6681819 3.8939923 ] [ -0.3316917 -0.0051915 -1.0196907 ] [ 0.8175629 -0.071179 0.501512 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.781245913147156e-10 -2.663464823124403e-10 -2.047614726220789e-09 ] [ 5.060846561772826e-10 1.13902741414224e-10 -4.161648965998138e-10 ] [ 5.592684284517523e-10 3.172456628780127e-09 -4.637270476778178e-09 ] [ -7.867895249300083e-10 -2.377327293885868e-10 4.83899236400234e-09 ] [ 1.194846286304939e-09 1.280091054720576e-11 -3.146591730284581e-09 ] [ -1.773736892266954e-09 -2.672722039421723e-09 6.23886342463522e-09 ] [ -5.314286870534073e-10 -8.3176999268832e-12 -1.633724599987186e-09 ] [ 1.309880164413448e-09 -1.140413296919232e-10 8.035108014506496e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.864769 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.746169440219261e-18 } }