{ "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" [ 5.42356 0 0 ] "si-unit" "m" "si-value" [ 5.42356e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0141122 5.36968 0 ] "si-unit" "m" "si-value" [ 1.41122e-12 5.36968e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.125956 0.0899535 5.38067 ] "si-unit" "m" "si-value" [ -1.25956e-11 8.99535e-12 5.380670000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0132742 0.0797855 -0.0480858 ] [ 1.38077 1.28242 1.3281 ] [ 0.0139699 2.87381 2.72647 ] [ 1.34708 4.2887 4.09361 ] [ 2.73598 0.0766444 2.67003 ] [ 4.1072 1.37855 3.98819 ] [ 2.71459 2.70679 -0.0921964 ] [ 4.08895 4.12737 1.11939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.32742e-12 7.97855e-12 -4.80858e-12 ] [ 1.38077e-10 1.28242e-10 1.3281e-10 ] [ 1.39699e-12 2.873810000000001e-10 2.72647e-10 ] [ 1.34708e-10 4.2887e-10 4.09361e-10 ] [ 2.73598e-10 7.66444e-12 2.67003e-10 ] [ 4.1072e-10 1.37855e-10 3.98819e-10 ] [ 2.71459e-10 2.70679e-10 -9.21964e-12 ] [ 4.08895e-10 4.12737e-10 1.11939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5706319 -0.4253738 0.4818155 ] [ -0.3847411 2.5105339 -0.0548554 ] [ 0.0485059 -0.6835448 -1.1795077 ] [ -0.4385353 -1.143914 -1.1863208 ] [ 0.5672271 -0.611242 -0.4357338 ] [ -1.5158784 2.3823987 -0.8317399 ] [ 0.6430673 -1.0641927 0.4600646 ] [ -0.4902774 -0.9646652 2.7462776 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.516429710062684e-09 -6.815239574608551e-10 7.719535296390624e-10 ] [ -6.164231954808749e-10 4.022318720305845e-09 -8.788803940463232e-11 ] [ 7.771501895086271e-11 -1.095159497829412e-09 -1.88977966099358e-09 ] [ -7.026110050555143e-10 -1.832752267005811e-09 -1.900695450528753e-09 ] [ 9.087979983041837e-10 -9.793176420510335e-10 -6.98122507252343e-10 ] [ -2.428704932455711e-09 3.817023498564313e-09 -1.33259422236653e-09 ] [ 1.03030739366098e-09 -1.705024663966028e-09 7.371047461777037e-10 ] [ -7.855109879866098e-10 -1.545564030339356e-09 4.400021764946734e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.035655 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.773548395621462e-18 } }