Sc and Ti-functionalized 4-tert-butylcalix[4]arene as reversible hydrogen storage material

标题
Sc and Ti-functionalized 4-tert-butylcalix[4]arene as reversible hydrogen storage material
作者
关键词
Metal functionalization, Dewar coordination, Hydrogen adsorption-desorption, Kubas-Niu-Rao-Jena Interaction, Molecular dynamics
出版物
出版商
Elsevier BV
发表日期
2019-02-20
DOI
10.1016/j.ijhydene.2019.01.169

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