{ "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" [ [ -7.032406604674887e-10 1.903241629614528e-11 -4.37846832373776e-09 ] [ 9.632681581874936e-10 -6.363124558338239e-11 4.641010597881773e-10 ] [ -5.280219789046003e-10 4.969492213249092e-09 -8.184649412456132e-09 ] [ -1.124673994449479e-09 -3.23557645958615e-10 8.649513909404122e-09 ] [ 1.703808291475517e-09 -2.304088596195859e-10 -6.126466248591562e-09 ] [ -1.758713602529036e-09 -4.012811724673342e-09 1.072520934438702e-08 ] [ -9.968494597241377e-10 2.356348393213114e-10 -3.575407573699894e-09 ] [ 2.444423406629393e-09 -5.937499930316237e-10 2.426167244906026e-09 ] ] "source-value" [ [ -0.4389283 0.0118791 -2.732825 ] [ 0.6012247 -0.0397155 0.2896691 ] [ -0.3295654 3.1017131 -5.1084564 ] [ -0.7019663 -0.2019488 5.398602 ] [ 1.0634335 -0.1438099 -3.8238395 ] [ -1.0977027 -2.5046001 6.6941492 ] [ -0.6221845 0.1470717 -2.2315939 ] [ 1.5256891 -0.3705896 1.5142945 ] ] } "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" -5.606757964172293e-18 "source-value" -34.994631 } }