{ "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" [ 5.50751 0 0 ] "si-unit" "m" "si-value" [ 5.50751e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0552432 5.46365 0 ] "si-unit" "m" "si-value" [ 5.52432e-12 5.46365e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.041151 -0.173599 5.4807 ] "si-unit" "m" "si-value" [ -4.115100000000001e-12 -1.73599e-11 5.4807e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0203681 -0.0104771 -0.043973 ] [ 1.36957 1.30557 1.36025 ] [ 0.0138031 2.57027 2.84477 ] [ 1.29725 4.08516 4.13225 ] [ 2.77149 -0.00701058 2.61036 ] [ 3.98017 1.30013 4.07827 ] [ 2.6961 2.74296 0.249943 ] [ 4.17055 4.00651 1.44609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03681e-12 -1.04771e-12 -4.3973e-12 ] [ 1.36957e-10 1.30557e-10 1.36025e-10 ] [ 1.38031e-12 2.57027e-10 2.84477e-10 ] [ 1.29725e-10 4.08516e-10 4.13225e-10 ] [ 2.77149e-10 -7.01058e-13 2.61036e-10 ] [ 3.98017e-10 1.30013e-10 4.07827e-10 ] [ 2.6961e-10 2.74296e-10 2.49943e-11 ] [ 4.170550000000001e-10 4.00651e-10 1.44609e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3641741 0.7960702 0.7137841 ] [ -1.8476996 -0.3010512 -0.2412994 ] [ 0.391575 -0.2589284 0.667635 ] [ 3.6877332 -0.8339773 -1.4820976 ] [ -0.7561319 -1.6048497 1.3117413 ] [ -0.5330272 0.5729709 2.1661439 ] [ -0.5191197 1.3147769 -2.5528238 ] [ 2.9408443 0.3149886 -0.5830833 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.390001091320881e-09 1.27544506295558e-09 1.143608197318769e-09 ] [ -2.960341101381512e-09 -4.82337194303785e-10 -3.866042572930675e-10 ] [ 6.273723102897601e-10 -4.148490289411507e-10 1.069669188227808e-09 ] [ 5.90839991678797e-09 -1.336178932337908e-09 -2.37458212446379e-09 ] [ -1.211456852421084e-09 -2.571252669237894e-09 2.101641243397799e-09 ] [ -8.540037180904859e-10 9.180005803787346e-10 3.470545113868533e-09 ] [ -8.317214467367098e-10 2.1065048107479e-09 -4.090074609381815e-09 ] [ 4.711751982872941e-09 5.046673707385229e-10 -9.342024312389127e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -216.22683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.464335718156961e-17 } }