{ "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" [ [ -0.3076766 -0.0989172 -1.6718801 ] [ 0.5292601 0.1383252 -0.0832959 ] [ 0.3797009 2.4646889 -3.4879688 ] [ -0.4927819 -0.2254433 3.3376656 ] [ 0.827819 0.0465934 -2.2089125 ] [ -1.4058641 -2.0154577 4.5028767 ] [ -0.5405505 -0.2095279 -1.404853 ] [ 1.0100932 -0.1002613 1.016368 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.929522552872334e-10 -1.584828252349977e-10 -2.678647209000766e-09 ] [ 8.479681585422701e-10 2.216214015074842e-10 -1.334547435884947e-10 ] [ 6.083479048767188e-10 3.948866933125269e-09 -5.588342065439831e-09 ] [ -7.895236393334035e-10 -3.611999845760007e-10 5.347529792368404e-09 ] [ 1.326312248054035e-09 7.465085616358272e-11 -3.539067964892879e-09 ] [ -2.252442593042034e-09 -3.22911920715134e-09 7.214403775085055e-09 ] [ -8.660573734617505e-10 -3.357007027853203e-10 -2.250822632260742e-09 ] [ 1.618347709869059e-09 -1.606363108310151e-10 1.628401047729254e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.677583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.716178936925153e-18 } }