{ "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" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0991669 0.3970536 0.8598939 ] [ -0.4193872 0.3353542 -0.7844266 ] [ -0.9422304 -0.4668994 -2.1351754 ] [ -0.0762922 2.7781615 -2.2284995 ] [ -0.8245232 -1.5789485 -0.2479804 ] [ 0.3261344 0.3210006 0.757724 ] [ -0.1410589 -2.5289903 1.4589437 ] [ 0.9781908 0.7432683 2.3195203 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.761059509537211e-09 6.361499951244749e-10 1.377701902948533e-09 ] [ -6.719323669027738e-10 5.372966589270874e-10 -1.256789959253633e-09 ] [ -1.509619518287033e-09 -7.480553029455476e-10 -3.420928107187288e-09 ] [ -1.222335791893978e-10 4.451105404106659e-09 -3.57044979836449e-09 ] [ -1.321031794347202e-09 -2.529754372147229e-09 -3.973083992966323e-10 ] [ 5.225249109186355e-10 5.142996565827726e-10 1.214007677819059e-09 ] [ -2.260012717357651e-10 -4.051889132889978e-09 2.337485487203449e-09 ] [ 1.567234430441649e-09 1.190847093241761e-09 3.716281196131003e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.207432 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.801070104960579e-18 } }