Proceedings of the Combustion Institute · 2024 · 18 citations · 26 references
EngineeringChemical EngineeringChemistryReaction EngineeringCombustion ProcessesAmmonia ProductionCoal CombustionHydrogen ProductionPyrolysisSynergistic Impacts
26
Molecular dynamics with coupling to an external bath
Herman J. C. Berendsen, Johan P. M. Postma, Wilfred F. van Gunsteren et al. · The Journal of Chemical Physics · 1984 · 31K citations · Full text
Natural Sciences, Chemistry, Physics +17
ReaxFF: A Reactive Force Field for Hydrocarbons
Adri C. T. van Duin, Siddharth Dasgupta, François Lorant et al. · The Journal of Physical Chemistry A · 2001 · 6.3K citations
Natural Sciences, Chemistry, Physics +17
Science and technology of ammonia combustion
Hideaki Kobayashi, Akihiro Hayakawa, K.D. Kunkuma A. Somarathne et al. · Proceedings of the Combustion Institute · 2018 · 2.4K citations · Full text
Malte Döntgen, Marie-Dominique Przybylski-Freund, Leif C. Kröger et al. · Journal of Chemical Theory and Computation · 2015 · 303 citations · Full text