Density functional theory investigation of As4, As2 and AsH3 adsorption on Ti-doped graphene
出版年份 2021 全文链接
标题
Density functional theory investigation of As4, As2 and AsH3 adsorption on Ti-doped graphene
作者
关键词
Arsenic species, Adsorption behavior, Ti-doped graphene, Partial , d, -band center, Fermi softness, Density functional theory
出版物
CHEMICAL ENGINEERING JOURNAL
Volume 421, Issue -, Pages 129747
出版商
Elsevier BV
发表日期
2021-04-16
DOI
10.1016/j.cej.2021.129747
参考文献
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