Reactive molecular dynamics simulations of the catalytic cracking of hydrocarbons on Metal-Doped Catalysts: The development of the ReaxFF force field

Chemical Engineering Science 2026

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Authors: Dongdong Chen, Liang Zhao, Dong Zhai, Yahui Zong, Dongyang Liu, Yuhao Zhang, Jingjing Wang, Jiaojiao Wang, Haifeng Li, Jinsen Gao, Chunming Xu
DOI: 10.1016/j.ces.2026.124085
Cited by: 1
References: 42

Fields of Study & Subjects

Zeolite Catalysis and Synthesis Heat transfer and supercritical fluids Catalysts for Methane Reforming

Publication details

Journal / source
Chemical Engineering Science
Publisher
Elsevier BV
Volume
332
Pages
124085–124085
Publication date
24 April 2026
Language
EN