{ "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" [ 5.33408 0 0 ] "si-unit" "m" "si-value" [ 5.33408e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.034982 5.4373 0 ] "si-unit" "m" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.179208 0.185424 5.40079 ] "si-unit" "m" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0492126 -0.0420999 -0.0477888 ] [ 1.41891 1.35069 1.31795 ] [ 0.0600152 2.70621 2.67075 ] [ 1.52388 3.98641 4.19062 ] [ 2.7955 -0.0317733 2.51171 ] [ 4.14719 1.34284 3.96242 ] [ 2.77343 2.76788 -0.181612 ] [ 4.04692 4.12597 1.21449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.92126e-12 -4.209990000000001e-12 -4.77888e-12 ] [ 1.41891e-10 1.35069e-10 1.31795e-10 ] [ 6.00152e-12 2.70621e-10 2.67075e-10 ] [ 1.52388e-10 3.98641e-10 4.19062e-10 ] [ 2.7955e-10 -3.17733e-12 2.51171e-10 ] [ 4.14719e-10 1.34284e-10 3.96242e-10 ] [ 2.77343e-10 2.76788e-10 -1.81612e-11 ] [ 4.04692e-10 4.12597e-10 1.21449e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8668704 -0.0215847 0.4253818 ] [ -0.5316075 0.4600756 -1.8418477 ] [ 1.6229224 0.7626963 -0.36513 ] [ -3.3240107 4.490595 -6.2326977 ] [ -1.6468425 0.3988429 3.7927286 ] [ -1.1448841 0.7594377 -0.994547 ] [ 1.3025475 -4.5313831 4.5132739 ] [ 0.8550045 -2.3186798 0.702838 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.593232729743544e-09 -3.458250170698176e-11 6.815367748738215e-10 ] [ -8.51729107941936e-10 7.371223701205325e-10 -2.950965324014252e-09 ] [ 2.600208326652626e-09 1.221974180630663e-09 -5.85002749552704e-10 ] [ -5.325652230829042e-09 7.194726322481377e-09 -9.985882539453933e-09 ] [ -2.638532551639824e-09 6.390167697520724e-10 6.076621091959515e-09 ] [ -1.83430653854565e-09 1.216753327894124e-09 -1.593439951686777e-09 ] [ 2.086911151981488e-09 -7.260076062708229e-09 7.231061925846838e-09 ] [ 1.369868220578793e-09 -3.71493456668122e-09 1.12607061180983e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.759652 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.569110178154397e-18 } }