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2016, Kyle E. Niemeyer, Nicholas J. Curtis, Chih-Jen Sung, “pyJac: analytical Jacobian generator for chemical kinetics”, in arXiv:
As a demonstration, we first establish the correctness of the Jacobian matrices for kinetic models of hydrogen, methane, ethylene, and isopentanol oxidation, then demonstrate the performance achievable on CPUs and GPUs using pyJac via matrix evaluation timing comparisons..