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Zuo, Zhi-Jun, Li, Na, Liu, Shi-Zhong, Han, Pei-De, Huang, Wei (2016) Initial stages of oxidation for Cu-based catalysts using density functional theory. Applied Surface Science, 366. 85-94 doi:10.1016/j.apsusc.2016.01.067

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Reference TypeJournal (article/letter/editorial)
TitleInitial stages of oxidation for Cu-based catalysts using density functional theory
JournalApplied Surface Science
AuthorsZuo, Zhi-JunAuthor
Li, NaAuthor
Liu, Shi-ZhongAuthor
Han, Pei-DeAuthor
Huang, WeiAuthor
Year2016 (March)Volume366
PublisherElsevier BV
DOIdoi:10.1016/j.apsusc.2016.01.067Search in ResearchGate
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Mindat Ref. ID9927689Long-form Identifiermindat:1:5:9927689:6
GUID0
Full ReferenceZuo, Zhi-Jun, Li, Na, Liu, Shi-Zhong, Han, Pei-De, Huang, Wei (2016) Initial stages of oxidation for Cu-based catalysts using density functional theory. Applied Surface Science, 366. 85-94 doi:10.1016/j.apsusc.2016.01.067
Plain TextZuo, Zhi-Jun, Li, Na, Liu, Shi-Zhong, Han, Pei-De, Huang, Wei (2016) Initial stages of oxidation for Cu-based catalysts using density functional theory. Applied Surface Science, 366. 85-94 doi:10.1016/j.apsusc.2016.01.067
In(n.d.) Applied Surface Science Vol. 366. Elsevier BV

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Zuo, Zhi-Jun, Wang, Le, Han, Pei-De, Huang, Wei (2014) Insight into the size effect on methanol decomposition over Cu-based catalysts based on density functional theory. Computational and Theoretical Chemistry, 1033. 14-22 doi:10.1016/j.comptc.2014.01.029
Zuo, Zhi-Jun, Han, Pei-De, Li, Zhe, Hu, Jian-Shui, Huang, Wei (2012) Can methanol be synthesized from CO by direct hydrogenation over Cu/ZnO catalysts?. Applied Surface Science, 261. 640-646 doi:10.1016/j.apsusc.2012.08.074
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Liu, Jiang-Tao, Wang, Ming-Fei, Gao, Zhi-Hua, Zuo, Zhi-Jun, Huang, Wei (2018) The role of catalysts in the decomposition of phenoxy compounds in coal: A density functional theory study. Applied Surface Science, 428. 541-548 doi:10.1016/j.apsusc.2017.09.170
Jin, Ya-Xin, Zhang, Xin-Yu, Zhang, Rui-Xin, Wang, Wen-Jing, Zhao, Jia-Xuan, Liu, Lei, Huang, Wei, Zuo, Zhi-Jun (2024) Design and catalytic performance of Cu/γ-Al2O3 for electrocatalytic methanol oxidation reaction by using density functional theory and molecular dynamics. Applied Surface Science, 649. 159129 doi:10.1016/j.apsusc.2023.159129
Zuo, Zhi-Jun, Wang, Le, Han, Pei-De, Huang, Wei (2014) Methanol synthesis by CO and CO2 hydrogenation on Cu/γ-Al2O3 surface in liquid paraffin solution. Applied Surface Science, 290. 398-404 doi:10.1016/j.apsusc.2013.11.092
Zuo, Zhi-Jun, Gao, Xiao-Yu, Han, Pei-De, Liu, Shi-Zhong, Huang, Wei (2016) Density Functional Theory (DFT) and Kinetic Monte Carlo (KMC) Study of the Reaction Mechanism of Hydrogen Production from Methanol on ZnCu(111). The Journal of Physical Chemistry C, 120 (48). 27500-27508 doi:10.1021/acs.jpcc.6b10261
Sun, Wei, Shi, Ruina, Wang, Xuhui, Liu, Shusen, Han, Xiaoxia, Zhao, Chaofan, Li, Zhong, Ren, Jun (2017) Density-functional theory study of dimethyl carbonate synthesis by methanol oxidative carbonylation on single-atom Cu 1 /graphene catalyst. Applied Surface Science, 425. 291-300 doi:10.1016/j.apsusc.2017.07.002
Zuo, Zhijun, Huang, Wei, Han, Peide, Li, Zhihong (2010) A density functional theory study of CH4 dehydrogenation on Co(111). Applied Surface Science, 256. 5929-5934 doi:10.1016/j.apsusc.2010.03.078
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