{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46308e-10 0.0 0.0 ] "source-value" [ 5.46308 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] "source-value" [ -0.0404011 5.38219 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] "source-value" [ 0.0107061 -0.144189 5.56456 ] } "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" [ [ 7.588858566844934e-10 1.41824674473216e-10 6.161056440746324e-10 ] [ -2.451945625864049e-09 5.899352104974989e-10 1.770521323789008e-09 ] [ 1.59076191346511e-09 -3.50054715283431e-09 3.888348075845453e-10 ] [ -6.273739124663808e-10 7.209038566234983e-10 1.435651189363911e-10 ] [ -9.30734359725529e-10 7.891460063038809e-10 7.491702576559622e-10 ] [ -6.388241881222522e-10 1.366037256060799e-09 1.523212224520238e-09 ] [ 2.991764911880587e-09 1.669093129544333e-10 -2.307286861166301e-09 ] [ -6.92534595851979e-10 -2.742093242966784e-10 -2.8841228358298e-09 ] ] "source-value" [ [ 0.4736593 0.08852 0.3845429 ] [ -1.5303841 0.3682086 1.1050725 ] [ 0.9928755 -2.1848697 0.2426916 ] [ -0.391576 0.4499528 0.0896063 ] [ -0.5809187 0.4925462 0.4675953 ] [ -0.3987227 0.8526134 0.9507143 ] [ 1.8673128 0.1041766 -1.4400952 ] [ -0.4322461 -0.171148 -1.8001279 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.777820759798487e-18 "source-value" -36.062321 } }