Zhang YF - Search Results

1

Blue-AsP monolayer as a promising anode material for lithium- and sodium-ion batteries: a DFT study.

Zhang J , Zhang YF , Li Y , Ren YR , Huang S , Lin W , Chen WK . Zhang J , et al. Among authors: zhang yf. Phys Chem Chem Phys. 2021 Mar 7;23(9):5143-5151. doi: 10.1039/d0cp05879c. Epub 2021 Feb 24. Phys Chem Chem Phys. 2021. PMID: 33624671

2

The adsorption and dissociation of Cl2 on the MgO (001) surface with vacancies: embedded cluster model study.

Xu YJ, Li JQ, Zhang YF, Chen WK. Xu YJ, et al. Among authors: zhang yf. J Chem Phys. 2004 May 8;120(18):8753-60. doi: 10.1063/1.1697375. J Chem Phys. 2004. PMID: 15267807

3

Structural characterizations and electronic properties of Ti-doped SnO2(110) surface: a first-principles study.

Lin W, Zhang YF, Li Y, Ding KN, Li JQ, Xu YJ. Lin W, et al. Among authors: zhang yf. J Chem Phys. 2006 Feb 7;124(5):054704. doi: 10.1063/1.2162896. J Chem Phys. 2006. PMID: 16468898

4

A theoretical study on the electronic structures of TiO2: Effect of Hartree-Fock exchange.

Zhang YF, Lin W, Li Y, Ding KN, Li JQ. Zhang YF, et al. J Phys Chem B. 2005 Oct 20;109(41):19270-7. doi: 10.1021/jp0523625. J Phys Chem B. 2005. PMID: 16853489

5

Deposition of (WO3)3 nanoclusters on the MgO(001) surface: a possible way to identify the charge states of the defect centers.

Zhu J, Lin S, Wen X, Fang Z, Li Y, Zhang Y, Huang X, Ning L, Ding K, Chen W. Zhu J, et al. J Chem Phys. 2013 Jan 21;138(3):034711. doi: 10.1063/1.4776219. J Chem Phys. 2013. PMID: 23343297

6

Probing the smallest molecular model of MoS2 catalyst: S2 units in the MoS(-/0 (n = 1-5) clusters.

Wang B, Wu N, Zhang XB, Huang X, Zhang YF, Chen WK, Ding KN. Wang B, et al. Among authors: zhang xb, zhang yf. J Phys Chem A. 2013 Jul 11;117(27):5632-41. doi: 10.1021/jp309163c. Epub 2013 Jun 27. J Phys Chem A. 2013. PMID: 23767784

7

Why the photocatalytic activity of Mo-doped BiVO4 is enhanced: a comprehensive density functional study.

Ding K, Chen B, Fang Z, Zhang Y, Chen Z. Ding K, et al. Phys Chem Chem Phys. 2014 Jul 14;16(26):13465-76. doi: 10.1039/c4cp01350f. Phys Chem Chem Phys. 2014. PMID: 24887757

8

N,F-Monodoping and N/F-codoping effects on the electronic structures and optical performances of Zn2GeO4.

Li Y, Ding K, Cheng B, Zhang Y, Lu Y. Li Y, et al. Phys Chem Chem Phys. 2015 Feb 28;17(8):5613-23. doi: 10.1039/c4cp05395h. Phys Chem Chem Phys. 2015. PMID: 25622752

9

Insight into the mechanism for the methanol synthesis via the hydrogenation of CO₂ over a Co-modified Cu(100) surface: A DFT study.

Qiu M, Tao H, Li R, Li Y, Huang X, Chen W, Su W, Zhang Y. Qiu M, et al. J Chem Phys. 2016 Oct 7;145(13):134701. doi: 10.1063/1.4963384. J Chem Phys. 2016. PMID: 27782435

10

Different Atomic Terminations Affect the Photocatalytic Nitrogen Fixation of Bismuth Oxybromide: A First Principles Study.

Liu H, Fang Z, Su Y, Suo Y, Huang S, Zhang Y, Ding K. Liu H, et al. Chem Asian J. 2018 Apr 4;13(7):799-808. doi: 10.1002/asia.201701670. Epub 2018 Mar 2. Chem Asian J. 2018. PMID: 29342324

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