Theoretical Survey of the Thiophene Hydrodesulfurization Mechanism on Clean and Single-Sulfur-Atom-Modified MoP(001)
Author:
Affiliation:
1. College of Science, China University of Petroleum, Qingdao, Shandong 266580, P. R. China
2. College of Science and Information, Qingdao Agricultural University, Qingdao, Shandong 266109, P. R. China
Funder
Ministry of Education of the People's Republic of China
Shandong Province
PetroChina Innovation Foundation
National Natural Science Foundation of China
Promotive Research Fund for Excellent Young and Middle-aged Scientists of Shandong Province
Publisher
American Chemical Society (ACS)
Subject
Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.6b07103
Reference63 articles.
1. Fundamental studies of hydrodesulfurization by metal surfaces
2. A DFT study of the adsorption of thiophene on Ni(100)
3. Adsorption and desulfurization reaction mechanism of thiophene and its hydrogenated derivatives over NbC(001) and NbN(001): an ab initio DFT study
4. B(C6F5)3-Catalyzed Hydrodesulfurization Using Hydrosilanes – Metal-Free Reduction of Sulfides
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