ReaxFF molecular dynamic simulation of primary and secondary reactions involving in sub-bituminous coal pyrolysis for tar production - Qian, Yanan; Zhan, Jin-Hui; Xu, Wei; Han, Zhennan; Liu, Xiaoxing; Xu, Guangwen (Carbon resources conversion, 2021)
Keywords: Primary formation; Reaction paths; ReaxFF MD simulation; Secondary upgrading; Sub-bituminous coal pyrolysis; Primary formation; ReaxFF MD simulation; Sub-bituminous coal pyrolysis; Secondary upgrading; Reaction paths