The thermal decomposition process of Composition B by ReaxFF/lg force field.

Meng, Jingwei; Zhang, Shuhai; Gou, Ruijun; Chen, Yahong; Li, Yang; Chen, Minghua; Li, Zhao

Meng, Jingwei; Zhang, Shuhai; Gou, Ruijun; Chen, Yahong; Li, Yang; Chen, Minghua; Li, Zhao.

Afiliación

Meng J; School of Environment and Safety Engineering, North University of China, Xueyuan Rd.3, Taiyuan, 030051, People's Republic of China.
Zhang S; School of Environment and Safety Engineering, North University of China, Xueyuan Rd.3, Taiyuan, 030051, People's Republic of China. zsh93y@nuc.edu.cn.
Gou R; School of Environment and Safety Engineering, North University of China, Xueyuan Rd.3, Taiyuan, 030051, People's Republic of China.
Chen Y; School of Environment and Safety Engineering, North University of China, Xueyuan Rd.3, Taiyuan, 030051, People's Republic of China.
Li Y; School of Environment and Safety Engineering, North University of China, Xueyuan Rd.3, Taiyuan, 030051, People's Republic of China.
Chen M; New Technology Applications Institute of Shijiazhuang, Shijiazhuang, 050000, People's Republic of China.
Li Z; Beijing Institute of Special Mechatronics, Beijing, 100012, People's Republic of China.

J Mol Model ; 26(9): 245, 2020 Aug 21.

Article en En | MEDLINE | ID: mdl-32820387

Palabras clave

Composition B; Molecular dynamic; Reaxff/lg; Thermal decomposition

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Texto completo: 1 Bases de datos: MEDLINE Idioma: En Revista: J Mol Model Asunto de la revista: BIOLOGIA MOLECULAR Año: 2020 Tipo del documento: Article