{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.882904 2.1120646 -1.0782716 ] [ 1.191383 -1.4362652 -0.8117551 ] [ 4.1029306 -0.2493995 1.3532972 ] [ 0.0091802 -0.8438784 1.4480403 ] [ -0.0403655 0.8275101 -1.7371469 ] [ -1.8915712 -1.4262715 2.4693972 ] [ -0.9353639 -0.7909894 -0.3563335 ] [ -4.3190971 1.8072292 -1.2872275 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.016744792865135e-09 3.383900551618556e-09 -1.727581562625794e-09 ] [ 1.908806004744822e-09 -2.301150543667337e-09 -1.300575053750333e-09 ] [ 6.573619538243599e-09 -3.99582051431283e-10 2.168221152697625e-09 ] [ 1.47083019354468e-11 -1.352042254417305e-09 2.32001633375035e-09 ] [ -6.467266091972699e-11 1.325817346619003e-09 -2.783216173005534e-09 ] [ -3.030631178187341e-09 -2.28513887104013e-09 3.956410493905025e-09 ] [ -1.498618184867112e-09 -1.267304734421679e-09 -5.70909207611439e-10 ] [ -6.91995645359716e-09 2.895500396522512e-09 -2.062365823142235e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.442597 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.678530076167849e-18 } }