Tuning the charge states of CrW2O9 clusters deposited on perfect and defective MgO(001) surfaces with different color centers: A comprehensive DFT study-Reference-Cited by-同舟云学术

Tuning the charge states of CrW2O9 clusters deposited on perfect and defective MgO(001) surfaces with different color centers: A comprehensive DFT study

Published:2016-05-07 Issue:17 Volume:144 Page:174706
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Zhu Jia¹,Zhang Hui¹,Tong Yawen¹,Wang Chengxing¹,Wang Bin²,Huang Xin²,Zhang Yongfan²³

Affiliation:

1. College of Chemistry and Chemical Engineering, Jiangxi Normal University, Nanchang, Jiangxi 330022, China

2. College of Chemistry, Fuzhou University, Fuzhou, Fujian 350108, China

3. State Key Laboratory of Photocatalysis on Energy and Environment, Fuzhou, Fujian 350002, China

Funder

Independent Research Project of State Key Laboratory of Photocatalysis on Energy and Enviroment

National Supercomputer Center in Guangzhou houses Tianhe-2

Natural Science Foundation of Jiangxi Provincial Educational Committee

Scientific Research Foundation of Graduate School of Jiangxi Normal University

Special Program for Applied Research on Super Computation of the NSFC-Guangdong Joint Fund (the second phase)

National Natural Science Foundation of China (NSFC)

Natural Science Foundation of Jiangxi Province (Jiangxi Province natural Science Fund)

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.4947549

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2. Reaction and Deactivation Pathways in Xylene Isomerization on Zirconia Modified by Tungsten Oxide

3. Reduction behavior and metathesis activity of catalystsIII. The activation of catalysts

4. Nb2O5-supported WO3: a comparative study with WO3/Al2O3

5. Reactivity of V2O5-WO3/TiO2 catalysts in the selective catalytic reduction of nitric oxide by ammonia

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