{ "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" [ 5.46308 0 0 ] "si-unit" "m" "si-value" [ 5.46308e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0404011 5.38219 0 ] "si-unit" "m" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0107061 -0.144189 5.56456 ] "si-unit" "m" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3507238 0.0773087 0.3836068 ] [ -1.4361093 0.2508695 1.1260752 ] [ 0.9867117 -2.1227854 0.1110081 ] [ -0.2100047 0.3735979 0.1266118 ] [ -0.726904 0.5259423 0.4960373 ] [ -0.3666231 0.9459768 0.8946623 ] [ 1.7658848 0.149728 -1.3169518 ] [ -0.3636793 -0.2006377 -1.8210496 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.61921472718135e-10 1.23862191724441e-10 6.146058465399015e-10 ] [ -2.300900745373454e-09 4.019372477717856e-10 1.804171358702684e-09 ] [ 1.580886417209823e-09 -3.401077138855576e-09 1.778545825394285e-10 ] [ -3.364646205981177e-10 5.985698209599763e-10 2.028544658774054e-10 ] [ -1.164628594366003e-09 8.426524569497798e-10 7.947393651047559e-10 ] [ -5.873949594652204e-10 1.515621912779197e-09 1.433407020571156e-09 ] [ 2.829259341586084e-09 2.398907010791424e-10 -2.109989384680478e-09 ] [ -5.826784719289094e-10 -3.214570321910841e-10 -2.917643094437192e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.237205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.805840265413687e-18 } }