ReaxFF Molecular Dynamics Simulation of the Cracking of Components of Vacuum Gasoil in the Presence of a Nickel Nanocluster

被引：0
|
作者：
R. Kh. Shayakhmetova
E. M. Khamitov
机构：
[1] Bashkir State University,
[2] Ufa Institute of Chemistry,undefined
[3] Ufa Federal Research Center,undefined
[4] Russian Academy of Sciences,undefined
来源：
Russian Journal of Physical Chemistry A | 2021年 / 95卷
关键词：
ReaxFF; molecular dynamics; cracking; gasoil; pentacosane; pentadecylbenzene; heptadecylcyclohexane; nanocluster; nanoheterogenous catalysis; nickel nanocluster;
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中图分类号：
学科分类号：
摘要：
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页码：317 / 325
页数：8
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