{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.448400000000001e-10 0.0 0.0 ] "source-value" [ 5.4484 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.76084e-13 5.4399e-10 0.0 ] "source-value" [ 0.00476084 5.4399 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.970310000000001e-12 -6.39637e-12 5.39979e-10 ] "source-value" [ -0.0697031 -0.0639637 5.39979 ] } "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" [ [ -1.389277148380827e-09 1.790188682679976e-09 1.737035672196626e-09 ] [ 1.674577860770318e-09 -1.280735450157462e-09 -8.664516691281293e-10 ] [ 2.355978610849033e-09 4.503310566901144e-09 -3.546803273618103e-09 ] [ 1.18060309636369e-09 -9.054191680285787e-10 -1.381962411018564e-09 ] [ 2.890339441336167e-10 1.87986074575187e-09 5.485118952726874e-10 ] [ -3.503251306534896e-09 -5.300861111104756e-09 2.259782164141918e-09 ] [ -3.65163320926406e-09 -2.522585913510446e-09 -9.864434827897036e-10 ] [ 3.043968312280789e-09 1.836241647468252e-09 2.236331265160931e-09 ] ] "source-value" [ [ -0.8671186 1.1173479 1.0841724 ] [ 1.0451893 -0.7993722 -0.5407966 ] [ 1.4704862 2.8107454 -2.2137405 ] [ 0.7368745 -0.5651182 -0.8625531 ] [ 0.1804008 1.1733168 0.3423542 ] [ -2.1865575 -3.3085373 1.4104451 ] [ -2.2791702 -1.5744743 -0.6156896 ] [ 1.8998956 1.1460919 1.3958082 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -9.02537e-13 -3.03023e-12 -4.91559e-12 ] [ 1.28054e-10 1.44048e-10 1.35481e-10 ] [ -5.35965e-12 2.57981e-10 2.82719e-10 ] [ 1.28029e-10 4.0563e-10 4.12138e-10 ] [ 2.62772e-10 -7.771450000000001e-12 2.68834e-10 ] [ 4.08246e-10 1.48548e-10 4.03991e-10 ] [ 2.84369e-10 2.84518e-10 1.89163e-12 ] [ 4.03071e-10 4.03913e-10 1.36727e-10 ] ] "source-value" [ [ -0.00902537 -0.0303023 -0.0491559 ] [ 1.28054 1.44048 1.35481 ] [ -0.0535965 2.57981 2.82719 ] [ 1.28029 4.0563 4.12138 ] [ 2.62772 -0.0777145 2.68834 ] [ 4.08246 1.48548 4.03991 ] [ 2.84369 2.84518 0.0189163 ] [ 4.03071 4.03913 1.36727 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.760203546111495e-18 "source-value" -35.952363 } }