A theoretical study on the surface reaction of tetrakis(dimethylamino)titanium on titanium oxide-Reference-Cited by-同舟云学术

A theoretical study on the surface reaction of tetrakis(dimethylamino)titanium on titanium oxide

Published:2023 Issue:33 Volume:25 Page:22250-22257
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Kim Hye-Lee¹²^ORCID,Hidayat Romel¹²^ORCID,Khumaini Khabib²³^ORCID,Lee Won-Jun¹²^ORCID

Affiliation:

1. Metal-organic Compounds Materials Research Center, Sejong University, Seoul, 05006, Republic of Korea

2. Departments of Nanotechnology and Advanced Materials Engineering, Sejong University, Seoul, 05006, Republic of Korea

3. Department of Chemistry, Universitas Pertamina, Jakarta 12220, Indonesia

Abstract

The chemisorption of TDMAT was simulated by DFT using a TiO2 slab model. Three NMe2 ligands would be released with low activation energies to form the surface species of –TiNMe2*.

Funder

National Research Foundation of Korea

Korea Basic Science Institute

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D3CP02009F

Reference56 articles.

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4. Atomic Layer Deposition with TiO2 for Enhanced Reactivity and Stability of Aromatic Hydrogenation Catalysts

5. Enhanced stability and activity towards photocatalytic CO2 reduction via supercycle ALD of Cu and TiO2

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