{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47211e-10 0.0 0.0 ] "source-value" [ 5.47211 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] "source-value" [ 0.102197 5.35978 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] "source-value" [ 0.0185088 0.0167086 5.27242 ] } "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" [ [ -1.98818951470233e-09 -1.284349960613987e-09 -1.807571177492022e-09 ] [ 2.943603322441676e-09 1.601185354124711e-09 2.124729249374176e-09 ] [ -1.21293934644831e-09 2.376557448019575e-09 -1.989679378742012e-09 ] [ -1.061096742218218e-09 2.029944961140634e-10 7.990126905877537e-10 ] [ -1.364273740254284e-09 -1.486440989331581e-09 -4.218344068554753e-09 ] [ 3.155287223458649e-09 -8.158403516360161e-10 -1.801201884553693e-09 ] [ -1.381998940645519e-09 9.014899900837287e-10 5.37436208510759e-09 ] [ 9.09607578150674e-10 -1.495595826542832e-09 1.518692644490623e-09 ] ] "source-value" [ [ -1.2409303 -0.8016282 -1.1281972 ] [ 1.8372527 0.9993813 1.3261517 ] [ -0.7570572 1.4833305 -1.2418602 ] [ -0.6622845 0.1266992 0.4987045 ] [ -0.8515127 -0.9277635 -2.6328833 ] [ 1.9693754 -0.5092075 -1.1242218 ] [ -0.8625759 0.5626658 3.354413 ] [ 0.5677324 -0.9334775 0.9478934 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.78677e-12 8.79346e-14 1.14128e-11 ] [ 1.32251e-10 1.35955e-10 1.26618e-10 ] [ 2.15185e-12 2.57215e-10 2.76138e-10 ] [ 1.39174e-10 4.08684e-10 3.88021e-10 ] [ 2.74481e-10 1.55651e-11 2.83937e-10 ] [ 4.07982e-10 1.36064e-10 4.14567e-10 ] [ 2.72904e-10 2.76199e-10 -1.6614e-11 ] [ 4.049000000000001e-10 4.11184e-10 1.31405e-10 ] ] "source-value" [ [ 0.0278677 0.000879346 0.114128 ] [ 1.32251 1.35955 1.26618 ] [ 0.0215185 2.57215 2.76138 ] [ 1.39174 4.08684 3.88021 ] [ 2.74481 0.155651 2.83937 ] [ 4.07982 1.36064 4.14567 ] [ 2.72904 2.76199 -0.16614 ] [ 4.049 4.11184 1.31405 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.728993305755974e-18 "source-value" -35.757564 } }