{ "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" [ 5.46308 0 0 ] "si-unit" "m" "si-value" [ 5.46308e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0404011 5.38219 0 ] "si-unit" "m" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0107061 -0.144189 5.56456 ] "si-unit" "m" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8508037 -0.1760616 0.5620916 ] [ -1.284947 0.4602633 0.9514323 ] [ 0.8647764 -1.7257173 0.1482012 ] [ -0.7195992 0.6842119 -0.0551078 ] [ 0.026012 0.0839142 0.1896997 ] [ -0.5852307 0.5884116 0.639181 ] [ 1.7046633 0.0808963 -1.1952833 ] [ -0.8564786 0.0040818 -1.2402147 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.363137797030137e-09 -2.820817793406413e-10 9.005700202680654e-10 ] [ -2.058712042367098e-09 7.374230986722566e-10 1.524362587333972e-09 ] [ 1.385524530299589e-09 -2.7649039121701e-09 2.37444497814505e-10 ] [ -1.152925014586383e-09 1.096228309853147e-09 -8.829242878372224e-11 ] [ 4.16758182602496e-11 1.344453693931353e-10 3.039324243127738e-10 ] [ -9.376429453144185e-10 9.427393089275213e-10 1.024080854659565e-09 ] [ 2.731171685595777e-09 1.296101605692231e-10 -1.915054958492673e-09 ] [ -1.372229989135515e-09 6.539764530781441e-12 -1.987042997112486e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.830652 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.900920956322076e-18 } }