Yan H - Search Results

1

Mechanism of Autocatalytic Reduction of CO₂ over MgCO₃ to High Value-Added Chemicals: A DFT & AIMD Study.

Guo JY, He SQ, Jie Y, Song HT, Lu H, Xu XY, Zhao J, Zhang YF, Hu CX, Lu J, Yan H. Guo JY, et al. Among authors: yan h. Langmuir. 2024 Aug 20;40(33):17796-17806. doi: 10.1021/acs.langmuir.4c02286. Epub 2024 Aug 9. Langmuir. 2024. PMID: 39121350

2

Effect of point defects on acetylene hydrogenation reaction over Ni(111) surface: a density functional theory study.

Yin P, Jie Y, Zhao XJ, Feng YL, Sun T, Rao DM, Pu M, Yan H. Yin P, et al. Among authors: yan h. Phys Chem Chem Phys. 2021 Dec 15;23(48):27340-27347. doi: 10.1039/d1cp03599a. Phys Chem Chem Phys. 2021. PMID: 34854437

3

A DFT study on methanol decomposition over single atom Pt/CeO₂ catalysts: the effect of the position of Pt.

Lu H, Zhong Y, Jie Y, Yin P, Zhao XJ, Feng YL, Shen TY, Guo JY, Zhang W, Pu M, Yan H. Lu H, et al. Among authors: yan h. Phys Chem Chem Phys. 2023 May 24;25(20):14232-14244. doi: 10.1039/d3cp01066j. Phys Chem Chem Phys. 2023. PMID: 37170792

4

Theoretical study on electrocatalytic carbon dioxide reduction over copper with copper-based layered double hydroxides.

Xu XY, Guo JY, Zhang W, Jie Y, Song HT, Lu H, Zhang YF, Zhao J, Hu CX, Yan H. Xu XY, et al. Among authors: yan h. Phys Chem Chem Phys. 2024 Jan 31;26(5):4480-4491. doi: 10.1039/d3cp03249c. Phys Chem Chem Phys. 2024. PMID: 38240307

5

Facilitating the dry reforming of methane with interfacial synergistic catalysis in an Ir@CeO_2-x catalyst.

Wang H, Cui G, Lu H, Li Z, Wang L, Meng H, Li J, Yan H, Yang Y, Wei M. Wang H, et al. Among authors: yan h. Nat Commun. 2024 May 4;15(1):3765. doi: 10.1038/s41467-024-48122-6. Nat Commun. 2024. PMID: 38704402 Free PMC article.

6

DFT study on the mechanism of methanol dehydrogenation over Ru_xP_y surfaces.

Lu H, Zhong Y, Jie Y, Yin P, Shen TY, Guo JY, Pu M, Yan H. Lu H, et al. Among authors: yan h. Phys Chem Chem Phys. 2024 Oct 30;26(42):26900-26910. doi: 10.1039/d4cp03025g. Phys Chem Chem Phys. 2024. PMID: 39412837

7

The reaction mechanism and selectivity of acetylene hydrogenation over Ni-Ga intermetallic compound catalysts: a density functional theory study.

Rao DM, Zhang ST, Li CM, Chen YD, Pu M, Yan H, Wei M. Rao DM, et al. Among authors: yan h. Dalton Trans. 2018 Mar 28;47(12):4198-4208. doi: 10.1039/c7dt04726f. Epub 2018 Feb 26. Dalton Trans. 2018. PMID: 29479598

8

Theoretical study on the reaction mechanism and selectivity of acetylene semi-hydrogenation on Ni-Sn intermetallic catalysts.

Rao DM , Sun T , Yang YS , Yin P , Pu M , Yan H , Wei M . Rao DM , et al. Among authors: yan h. Phys Chem Chem Phys. 2019 Jan 17;21(3):1384-1392. doi: 10.1039/c8cp06032k. Phys Chem Chem Phys. 2019. PMID: 30601513

9

Manganese-based layered double hydroxide nanoparticles as highly efficient ozone decomposition catalysts with tunable valence state.

Wang S , Zhu YQ , Zhang Y , Wang B , Yan H , Liu W , Lin Y . Wang S , et al. Among authors: yan h. Nanoscale. 2020 Jun 28;12(24):12817-12823. doi: 10.1039/d0nr02796k. Epub 2020 Jun 15. Nanoscale. 2020. PMID: 32538395

10

Anion exchange behavior of M^IIAl layered double hydroxides: a molecular dynamics and DFT study.

Zhao XJ, Zhu YQ, Xu SM, Liu HM, Yin P, Feng YL, Yan H. Zhao XJ, et al. Among authors: yan h. Phys Chem Chem Phys. 2020 Sep 16;22(35):19758-19768. doi: 10.1039/d0cp02537b. Phys Chem Chem Phys. 2020. PMID: 32844826

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