Computational screening of MOF-supported transition metal catalysts for activity and selectivity in ethylene dimerization

标题
Computational screening of MOF-supported transition metal catalysts for activity and selectivity in ethylene dimerization
作者
关键词
Density functional theory, Ethylene dimerization, Linker functionalization, Metal-organic framework, Transition metal catalysts
出版物
JOURNAL OF CATALYSIS
Volume 360, Issue -, Pages 160-167
出版商
Elsevier BV
发表日期
2018-02-22
DOI
10.1016/j.jcat.2017.12.007

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