{ "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" [ [ 0.8262413 0.1364703 0.4326067 ] [ -0.3778385 0.19074 -0.4272913 ] [ -0.5502592 -0.3576452 -1.4445627 ] [ -0.3068335 1.8325132 -1.3627326 ] [ -0.4476703 -0.9486883 -0.2665365 ] [ 0.2056188 0.2105838 0.513577 ] [ 0.0311539 -1.6542419 0.8971822 ] [ 0.6195876 0.5902682 1.6577572 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.323784493999399e-09 2.186495240935622e-10 6.931123407414394e-10 ] [ -6.053640111381408e-10 3.05599168651392e-10 -6.84596131131239e-10 ] [ -8.816124256201112e-10 -5.730107779813401e-10 -2.314444585219725e-09 ] [ -4.916014601782368e-10 2.936009806347394e-09 -2.183338312121998e-09 ] [ -7.172468884865222e-10 -1.519966214686497e-09 -4.270385488898592e-10 ] [ 3.29437634156951e-10 3.37392441079223e-10 8.228410623806015e-10 ] [ 4.991405022674112e-11 -2.650387697327772e-09 1.43744434543791e-09 ] [ 9.92688767257582e-10 9.457139100416987e-10 2.65601982880287e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.442094240654235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.794531561016655e-18 } }