Cui G - Search Results

1

Early-Time Excited-State Relaxation Dynamics of Iridium Compounds: Distinct Roles of Electron and Hole Transfer.

Liu XY, Zhang YH, Fang WH, Cui G. Liu XY, et al. Among authors: cui g. J Phys Chem A. 2018 Jun 28;122(25):5518-5532. doi: 10.1021/acs.jpca.8b04392. Epub 2018 Jun 18. J Phys Chem A. 2018. PMID: 29874071

2

Combined CASSCF and MR-CI study on photoinduced dissociation and isomerization of acryloyl chloride.

Cui GL, Li QS, Zhang F, Fang WH, Yu JG. Cui GL, et al. J Phys Chem A. 2006 Oct 26;110(42):11839-46. doi: 10.1021/jp063457p. J Phys Chem A. 2006. PMID: 17048815

3

Conical intersection is responsible for the fluorescence disappearance below 365 nm in cyclopropanone.

Cui G, Ai Y, Fang W. Cui G, et al. J Phys Chem A. 2010 Jan 21;114(2):730-4. doi: 10.1021/jp908936u. J Phys Chem A. 2010. PMID: 19873995

4

Reformulating time-dependent density functional theory with non-orthogonal localized molecular orbitals.

Cui G, Fang W, Yang W. Cui G, et al. Phys Chem Chem Phys. 2010 Jan 14;12(2):416-21. doi: 10.1039/b916688b. Epub 2009 Nov 13. Phys Chem Chem Phys. 2010. PMID: 20023819

5

Insights into the mechanistic photodissociation of methyl formate.

Cui G, Zhang F, Fang W. Cui G, et al. J Chem Phys. 2010 Jan 21;132(3):034306. doi: 10.1063/1.3297892. J Chem Phys. 2010. PMID: 20095738

6

Insights into mechanistic photochemistry of urea.

Cui G, Ding L, Feng F, Liu Y, Fang W. Cui G, et al. J Chem Phys. 2010 May 21;132(19):194308. doi: 10.1063/1.3397067. J Chem Phys. 2010. PMID: 20499964

7

Efficient construction of nonorthogonal localized molecular orbitals in large systems.

Cui G, Fang W, Yang W. Cui G, et al. J Phys Chem A. 2010 Aug 26;114(33):8878-83. doi: 10.1021/jp1027838. J Phys Chem A. 2010. PMID: 20550205

8

Ultrafast deactivation processes in the 2-aminopyridine dimer and the adenine-thymine base pair: similarities and differences.

Ai YJ, Zhang F, Cui GL, Luo Y, Fang WH. Ai YJ, et al. J Chem Phys. 2010 Aug 14;133(6):064302. doi: 10.1063/1.3464485. J Chem Phys. 2010. PMID: 20707565

9

Ab initio based surface-hopping dynamics study on ultrafast internal conversion in cyclopropanone.

Cui G, Fang W. Cui G, et al. J Phys Chem A. 2011 Mar 10;115(9):1547-55. doi: 10.1021/jp110632g. Epub 2011 Feb 14. J Phys Chem A. 2011. PMID: 21322652

10

Mechanistic photodissociation of glycolaldehyde: insights from ab initio and RRKM calculations.

Cui G, Fang W. Cui G, et al. Chemphyschem. 2011 May 9;12(7):1351-7. doi: 10.1002/cphc.201000968. Epub 2011 Apr 5. Chemphyschem. 2011. PMID: 21472960

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