{ "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" [ 5.39006 0 0 ] "si-unit" "m" "si-value" [ 5.39006e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.23331 5.36322 0 ] "si-unit" "m" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.160148 -0.0213292 5.4933 ] "si-unit" "m" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0435246 0.752126 2.7115178 ] [ 0.1771491 -0.0046581999999999995 -0.671214 ] [ 0.4897099 -0.2662579 0.1813811 ] [ 3.1300073 -2.8108037 -2.2534158 ] [ -2.6671341 1.5669918 2.968737 ] [ -0.3494907 0.7947738 0.6088676 ] [ -0.4610311 0.4958018 -0.7829073 ] [ 2.7243143 -0.5279738 -2.7629663 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.876263958949672e-09 1.205038693095821e-09 4.344330426043051e-09 ] [ 2.838241464157613e-10 -7.46325913501056e-12 -1.075403378353651e-09 ] [ 7.84601752754306e-10 -4.265921824833043e-10 2.906045578749869e-10 ] [ 5.014824518993332e-09 -4.503403973798138e-09 -3.610370111701329e-09 ] [ -4.27321989955845e-09 2.51059762694531e-09 4.75644101470393e-09 ] [ -5.599458287270266e-10 1.273368001184375e-09 9.75513433882606e-10 ] [ -7.386532498817069e-10 7.943620525105575e-10 -1.254355772313652e-09 ] [ 4.364832679171118e-09 -8.459072787549351e-10 -4.426760009918279e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.327402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.218114797080317e-18 } }