{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.449760000000001e-10 0.0 0.0 ] "source-value" [ 5.44976 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.55309e-12 5.38277e-10 0.0 ] "source-value" [ -0.0355309 5.38277 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.055e-12 1.48675e-11 5.46244e-10 ] "source-value" [ 0.05055 0.148675 5.46244 ] } "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" [ [ 9.750406315618079e-10 2.130681816173434e-10 -2.89087889420439e-09 ] [ 8.47092889454327e-10 -1.282098582026438e-10 2.556403856533982e-09 ] [ 5.70985626732649e-10 -2.663058671351031e-09 2.084197545438839e-09 ] [ -2.34033944441808e-09 -1.576128112863709e-09 1.041658494584024e-09 ] [ 2.315375770271733e-09 2.777119707815389e-09 -1.40762767830716e-09 ] [ 1.157283896300932e-09 -5.31217680392448e-12 -1.848590103337743e-09 ] [ 2.520047585090112e-10 1.958949150502082e-09 -5.221979066703302e-10 ] [ -3.777444128412381e-09 -5.764282207135066e-10 9.87034846180441e-10 ] ] "source-value" [ [ 0.6085725 0.1329867 -1.8043447 ] [ 0.5287138 -0.0800223 1.5955818 ] [ 0.3563812 -1.6621505 1.3008538 ] [ -1.460725 -0.9837418 0.6501521 ] [ 1.4451439 1.7333418 -0.8785721 ] [ 0.7223198 -0.0033156 -1.1537992 ] [ 0.157289 1.2226799 -0.3259303 ] [ -2.3576952 -0.3597782 0.6160587 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.26933e-12 -2.89977e-12 1.41129e-11 ] [ 1.38935e-10 1.3881e-10 1.19735e-10 ] [ 1.27821e-12 2.83796e-10 2.59214e-10 ] [ 1.40644e-10 4.238000000000001e-10 3.96398e-10 ] [ 2.76811e-10 5.11022e-12 2.830360000000001e-10 ] [ 4.1335e-10 1.52222e-10 4.23862e-10 ] [ 2.69114e-10 2.71897e-10 2.78438e-14 ] [ 4.17588e-10 4.12802e-10 1.32379e-10 ] ] "source-value" [ [ 0.0326933 -0.0289977 0.141129 ] [ 1.38935 1.3881 1.19735 ] [ 0.0127821 2.83796 2.59214 ] [ 1.40644 4.238 3.96398 ] [ 2.76811 0.0511022 2.83036 ] [ 4.1335 1.52222 4.23862 ] [ 2.69114 2.71897 0.000278438 ] [ 4.17588 4.12802 1.32379 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.455474900524348e-17 "source-value" 153.25869 } }