{ "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" [ [ -0.1990997 0.1374915 -0.8458153 ] [ -0.5287033 -0.4046795 1.4915962 ] [ -0.0153598 -0.612155 -1.5799921 ] [ -5.2428841 -5.3740171 6.2874665 ] [ 5.9112225 5.45192 -6.2400431 ] [ -0.0938173 -0.4030328 1.1713031 ] [ 0.0129042 0.2252687 -1.5856982 ] [ 0.1557374 0.9792041 1.301183 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.189928845482938e-10 2.202856668587232e-10 -1.355145499174938e-09 ] [ -8.470760665998086e-10 -6.483680338170336e-10 2.389800559314121e-09 ] [ -2.460911246016384e-11 -9.80780429305824e-10 -2.531426403668696e-09 ] [ -8.40002633058405e-09 -8.610124557399415e-09 1.00736318303632e-08 ] [ 9.470822489846928e-09 8.734938762471936e-09 -9.997651167604357e-09 ] [ -1.503118846865798e-10 -6.457297295755623e-10 1.876634442690564e-09 ] [ 2.067480755012736e-11 3.609202445380089e-10 -2.540568583684642e-09 ] [ 2.495188212641779e-10 1.568857916011505e-09 2.084724981982406e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -60.306 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.66208632939648e-18 } }