{ "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" [ [ 0.4625243 0.0414959 0.3161554 ] [ -1.6450956 0.3828599 1.0343711 ] [ 1.2004158 -2.2119493 0.0823875 ] [ -0.3202491 0.3160452 0.1927908 ] [ -0.5033795 0.4605182 0.5123263 ] [ -0.5685084 1.192769 0.9409013 ] [ 1.8955923 -0.0732136 -1.2896713 ] [ -0.5212997 -0.1085253 -1.789261 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.410456200118855e-10 6.648376083905472e-11 5.065367904196722e-10 ] [ -2.635733709300949e-09 6.134091808218259e-10 1.657245193651179e-09 ] [ 1.923278129998929e-09 -3.543933454854926e-09 1.3199932634616e-10 ] [ -5.130956208522413e-10 5.063602305560602e-10 3.088849124653287e-10 ] [ -8.065028662899936e-10 7.378314934928986e-10 8.208372200809671e-10 ] [ -9.108508672084148e-10 1.911026605814995e-09 1.507490065340327e-09 ] [ 3.0370736656285e-09 -1.173011182446029e-10 -2.066281205376743e-09 ] [ -8.352141917700538e-10 -1.738766984253063e-10 -2.866712142709229e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.370910038775914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.783126594614679e-18 } }