Insights into the reaction pathway of thiophene hydrodesulfurization over corner site of MoS2 catalyst: A density functional theory study-Reference-Cited by-同舟云学术

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Insights into the reaction pathway of thiophene hydrodesulfurization over corner site of MoS2 catalyst: A density functional theory study

Published:2019-02 Issue: Volume:463 Page:45-53
ISSN:2468-8231
Container-title:Molecular Catalysis
language:en
Short-container-title:Molecular Catalysis

Author:

Li Shuo,Liu Yibin^ORCID,Feng Xiang,Chen Xiaobo,Yang Chaohe^ORCID

Funder

National Science Foundation of China

Key Research and Development Plan of Shandong Province

Natural Science Foundation of Shandong Province

Independent Innovation Foundation of Qingdao

Fundamental Research Funds for the Central Universities

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,Process Chemistry and Technology,Catalysis

Reference56 articles.

1. Atomic scale analysis of sterical effects in the adsorption of 4,6-dimethyldibenzothiophene on a CoMoS hydrotreating catalyst;Grønborg;J. Catal.,2016

2. Hydrodesulfurization of thiophene over γ-Mo2N catalyst;Jaf;Mol. Catal.,2018

3. Mechanisms of hydrodesulfurization and hydrodenitrogenation;Prins;Catal. Today,2006

4. MoS2 nanoparticle morphologies in hydrodesulfurization catalysis studied by scanning tunneling microscopy;Walton;J. Catal.,2013

5. Edge wetting effects of γ-Al2O3 and anatase-TiO2 supports by MoS2 and CoMoS active phases: a DFT study;Costa;J. Catal.,2007

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2. A computational study of the role of cobalt in thiophene adsorption on small Mo and MoCo clusters as site models for the HDS process;Surface Science;2024-11

3. Identifying efficient and inexpensive hydrodesulfurization catalysts through Machine Learning-Assisted analysis of Metal–Sulfur bonds in transition metal sulfides;Chemical Engineering Science;2024-10

4. Non-equilibrium electronic structure of Fe-based bulk catalysts: Dual-channel electron transfer behavior among Fe, Zn, and P species and its impact on hydrodesulfurization reaction pathway;Fuel;2024-05

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