{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.18551e-10 0.0 0.0 ] "source-value" [ 5.18551 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] "source-value" [ 0.238045 5.44258 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] "source-value" [ 0.0219846 -0.0831786 5.06218 ] } "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" [ [ -3.108792859011342e-09 -5.944268005015482e-09 -1.255895784481565e-09 ] [ 5.418406721501693e-09 1.145505494873121e-09 -1.988390908303565e-10 ] [ 1.90651936254536e-09 -1.92171921214689e-09 3.655823381780438e-09 ] [ -4.160353766417882e-09 5.897351467028596e-09 -1.374706793973609e-09 ] [ -4.399862188155303e-09 -3.82373004968132e-09 -5.528823286806718e-09 ] [ 6.654692024362327e-09 -3.628279562403956e-10 8.732589971545843e-10 ] [ -5.898075170208211e-10 -1.528454866858819e-09 8.422577607392458e-09 ] [ -1.720801777804032e-09 6.538142967823528e-09 -4.593395030235232e-09 ] ] "source-value" [ [ -1.9403559 -3.7101203 -0.7838685 ] [ 3.3819035 0.7149683 -0.1241056 ] [ 1.1899558 -1.1994428 2.2817855 ] [ -2.5966886 3.6808373 -0.8580245 ] [ -2.746178 -2.3865846 -3.4508201 ] [ 4.1535321 -0.2264594 0.5450454 ] [ -0.3681289 -0.9539865 5.2569595 ] [ -1.07404 4.0807879 -2.8669717 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.71889000015393e-18 "source-value" -29.452995 } }