Effects of ligand functionalization on the photocatalytic properties of titanium-based mof: a density functional theory study

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  • who: Yi Li and colleagues from the College Fuzhou University, Fuzhou, Fujian, China have published the paper: Effects of ligand functionalization on the photocatalytic properties of titanium-based MOF: A density functional theory study, in the Journal: (JOURNAL) of 14/03/2018
  • what: In the above sections, the authors focus on the situation that the BDC linker is modified by one functional_group, and it is necessary to investigate what will happen if more than one foreign group is introduced. In the present work, the electronic structures, optical absorptions and photocatalytic properties of pristine and some . . .

     

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