It's a gas: Oxidative dehydrogenation of propane over boron nitride catalysts

Supplemental archive for the above paper. Submitted version. Changes since v0.3: - more focus on gas-phase chemistry, removed C-C scission mechanism - incorporated M6 and M7 - added a schematic of reactor Changes since v0.2: - added C-C scission limit mechanism (M5) + fitting of M5-R15 - modified detailed C-C scission mechanism to include CO formation, based on Rh work - re-calculated relevant cases Changes since v0.1: - includes grid-sensitivity test - modified oxygen adsorption sensitivity analysis - added C-C scission limit mechanism - significantly modified presentation of plot_mech.ipynb - use of different mechanisms in plot_all.ipynb