{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.39143e-10 0.0 0.0 ] "source-value" [ 5.39143 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.44963e-11 5.178410000000001e-10 0.0 ] "source-value" [ 0.144963 5.17841 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.44779e-11 4.21312e-11 5.38784e-10 ] "source-value" [ -0.144779 0.421312 5.38784 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.841643585368276e-10 -7.455432502217952e-10 4.395239908604294e-10 ] [ 1.9338271813056e-13 7.59185303494921e-10 1.48264575335223e-09 ] [ 1.781870341882445e-10 -1.239094559347546e-10 -7.331496129715968e-10 ] [ -3.851185589125997e-10 -8.925790041541633e-11 -9.725718376068174e-10 ] [ 5.554983466453479e-10 9.540945755097792e-11 5.878257847585536e-11 ] [ -1.056123425769592e-09 5.581715783371527e-10 -7.20795229048608e-10 ] [ 5.198914132070266e-10 2.761816037168832e-10 1.760667136482778e-10 ] [ -5.966927108310471e-10 -7.302373365279687e-10 2.694973228549056e-10 ] ] "source-value" [ [ 0.4894369 -0.4653315 0.2743293 ] [ 0.0001207 0.4738462 0.9253947 ] [ 0.1112156 -0.0773382 -0.457596 ] [ -0.2403721 -0.0557104 -0.6070316 ] [ 0.3467148 0.0595499 0.0366892 ] [ -0.6591804 0.3483833 -0.449885 ] [ 0.3244907 0.172379 0.1098922 ] [ -0.3724263 -0.4557783 0.168207 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.5223e-11 6.929040000000001e-12 -4.288980000000001e-13 ] [ 1.42734e-10 1.24068e-10 1.17973e-10 ] [ -3.32931e-11 2.76994e-10 2.80275e-10 ] [ 1.2591e-10 4.25807e-10 3.96691e-10 ] [ 2.6931e-10 1.04845e-11 2.7319e-10 ] [ 4.09744e-10 1.52781e-10 4.38962e-10 ] [ 2.50984e-10 2.47613e-10 -2.02936e-11 ] [ 4.16866e-10 4.11218e-10 1.07304e-10 ] ] "source-value" [ [ 0.15223 0.0692904 -0.00428898 ] [ 1.42734 1.24068 1.17973 ] [ -0.332931 2.76994 2.80275 ] [ 1.2591 4.25807 3.96691 ] [ 2.6931 0.104845 2.7319 ] [ 4.09744 1.52781 4.38962 ] [ 2.50984 2.47613 -0.202936 ] [ 4.16866 4.11218 1.07304 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.404320544869282e-18 "source-value" 33.731116 } }