Teng BT - Search Results

1

A density functional theory study of the CH(2)I(2) reaction on Ag(111): Thermodynamics, kinetics, and electronic structures.

Teng BT, Huang WX, Wu FM, Lan YZ, Cao DB. Teng BT, et al. J Chem Phys. 2010 Jan 14;132(2):024715. doi: 10.1063/1.3292641. J Chem Phys. 2010. PMID: 20095702

2

A DFT study of the structures of Au(x) clusters on a CeO2(111) surface.

Teng BT, Wu FM, Huang WX, Wen XD, Zhao LH, Luo MF. Teng BT, et al. Chemphyschem. 2012 Apr 10;13(5):1261-71. doi: 10.1002/cphc.201101007. Epub 2012 Feb 9. Chemphyschem. 2012. PMID: 22323361

3

Hydrogen fluoride adsorption and reaction on the α-Al2O3(0001) surface: a density functional theory study.

Quan JL, Teng BT, Wen XD, Zhao Y, Liu R, Luo MF. Quan JL, et al. Among authors: teng bt. J Chem Phys. 2012 Mar 21;136(11):114701. doi: 10.1063/1.3694102. J Chem Phys. 2012. PMID: 22443784

4

Choosing a proper exchange-correlation functional for the computational catalysis on surface.

Teng BT, Wen XD, Fan M, Wu FM, Zhang Y. Teng BT, et al. Phys Chem Chem Phys. 2014 Sep 14;16(34):18563-9. doi: 10.1039/c4cp01868k. Phys Chem Chem Phys. 2014. PMID: 25072632

5

Effects of strong interactions between Ti and ceria on the structures of Ti/CeO₂.

Yao XD, Zhu KJ, Teng BT, Yu CM, Zhang YL, Liu Y, Fan M, Wen XD. Yao XD, et al. Among authors: teng bt. Phys Chem Chem Phys. 2016 Nov 30;18(47):32494-32502. doi: 10.1039/c6cp05406d. Phys Chem Chem Phys. 2016. PMID: 27869271

6

Mechanism of Graphene Formation via Detonation Synthesis: A DFTB Nanoreactor Approach.

Lei T, Guo W, Liu Q, Jiao H, Cao DB, Teng B, Li YW, Liu X, Wen XD. Lei T, et al. J Chem Theory Comput. 2019 Jun 11;15(6):3654-3665. doi: 10.1021/acs.jctc.9b00158. Epub 2019 May 31. J Chem Theory Comput. 2019. PMID: 31117479

7

The active sites of Cu-ZnO catalysts for water gas shift and CO hydrogenation reactions.

Zhang Z, Chen X, Kang J, Yu Z, Tian J, Gong Z, Jia A, You R, Qian K, He S, Teng B, Cui Y, Wang Y, Zhang W, Huang W. Zhang Z, et al. Nat Commun. 2021 Jul 15;12(1):4331. doi: 10.1038/s41467-021-24621-8. Nat Commun. 2021. PMID: 34267215 Free PMC article.

8

Oxidative Coupling of Methanol with Molecularly Adsorbed Oxygen on Au Surface to Methyl Formate.

Sun G, Wang F, Jin Y, Chen X, Chai P, Wu L, Teng BT, Huang W. Sun G, et al. Among authors: teng bt. J Phys Chem Lett. 2021 Jul 29;12(29):6941-6945. doi: 10.1021/acs.jpclett.1c01564. Epub 2021 Jul 20. J Phys Chem Lett. 2021. PMID: 34282915

9

Step Site-Specific Semihydrogenation of Acetylene on the Au Surface.

Wu Z, Wang F, Sun G, Xiong F, Teng B, Huang W. Wu Z, et al. J Phys Chem Lett. 2022 Aug 25;13(33):7667-7672. doi: 10.1021/acs.jpclett.2c01810. Epub 2022 Aug 12. J Phys Chem Lett. 2022. PMID: 35960022

10

Pinpointing the active sites and reaction mechanism of CO oxidation on NiO.

Wang F , Xu Y , Liu X , Liu Y , Liu J , Teng B . Wang F , et al. Phys Chem Chem Phys. 2019 Aug 15;21(32):17852-17858. doi: 10.1039/c9cp03132d. Phys Chem Chem Phys. 2019. PMID: 31378806

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