{ "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" [ [ 1.9742996 2.9013328 -1.8245976 ] [ 1.5447894 -1.6535481 -0.9364119 ] [ 5.7335263 -1.3549664 2.3363114 ] [ -0.3092929 -1.1865746 1.823649 ] [ 0.2823242 1.0158877 -2.2215625 ] [ -2.2032705 -2.4202092 3.7429033 ] [ -1.2126932 -0.9888178 -0.4934622 ] [ -5.8096829 3.6868956 -2.4268293 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.163176661574792e-09 4.648447581320202e-09 -2.92332761708779e-09 ] [ 2.47502546073966e-09 -2.649276107188261e-09 -1.500297253618908e-09 ] [ 9.186121792601928e-09 -2.170895488049541e-09 3.743183503988517e-09 ] [ -4.955418533594322e-10 -1.901102082955112e-09 2.921807792345299e-09 ] [ 4.523332327260634e-10 1.627631522298284e-09 -3.559335499146e-09 ] [ -3.530028484398326e-09 -3.877602597685071e-09 5.996792161175169e-09 ] [ -1.942948693243139e-09 -1.58426076139089e-09 -7.906136000885339e-10 ] [ -9.308138116641545e-09 5.907057933650389e-09 -3.888209167132429e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.963068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.601701014104061e-18 } }