{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9381078 3.7832759 6.7686861 ] [ -0.3767072 -1.3358768 -4.0559082 ] [ -1.9135446 -0.1436232 1.7609722 ] [ -5.2853103 -5.5572104 -3.2158874 ] [ 5.0754814 8.6129248 -0.298108 ] [ 2.5154837 -4.2966362 -5.2734929 ] [ 0.4741812 0.626401 9.8387512 ] [ 3.4485236 -1.689255 -5.525013 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.309544247350122e-09 6.061476197016078e-09 1.084463062295393e-08 ] [ -6.035514687270298e-10 -2.140310577229118e-09 -6.498281294151011e-09 ] [ -3.065836420978088e-09 -2.301097332444826e-10 2.821388488718742e-09 ] [ -8.468000596333435e-09 -8.903632579746617e-09 -5.152419607405298e-09 ] [ 8.131817638385253e-09 1.379942675126852e-08 -4.776216680734464e-10 ] [ 4.030249174143481e-09 -6.883970067722953e-09 -8.449067034334791e-09 ] [ 7.59722032662889e-10 1.003605037445741e-09 1.576341715050795e-08 ] [ 5.525143888197052e-09 -2.706484867569504e-09 -8.852046658216072e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.926007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.711845269889714e-18 } }