Prezhdo OV - Search Results

1

Interplay between Localized and Free Charge Carriers Can Explain Hot Fluorescence in the CH₃NH₃PbBr₃ Perovskite: Time-Domain Ab Initio Analysis.

Zhang Z, Long R, Tokina MV, Prezhdo OV. Zhang Z, et al. Among authors: prezhdo ov. J Am Chem Soc. 2017 Dec 6;139(48):17327-17333. doi: 10.1021/jacs.7b06401. Epub 2017 Nov 20. J Am Chem Soc. 2017. PMID: 29117679

2

Ab initio nonadiabatic molecular dynamics of the ultrafast electron injection across the alizarin-TiO2 interface.

Duncan WR, Stier WM, Prezhdo OV. Duncan WR, et al. Among authors: prezhdo ov. J Am Chem Soc. 2005 Jun 1;127(21):7941-51. doi: 10.1021/ja042156v. J Am Chem Soc. 2005. PMID: 15913385

3

Time-domain ab initio study of charge relaxation and recombination in dye-sensitized TiO2.

Duncan WR, Craig CF, Prezhdo OV. Duncan WR, et al. Among authors: prezhdo ov. J Am Chem Soc. 2007 Jul 11;129(27):8528-43. doi: 10.1021/ja0707198. Epub 2007 Jun 19. J Am Chem Soc. 2007. PMID: 17579405

4

Temperature independence of the photoinduced electron injection in dye-sensitized TiO2 rationalized by ab initio time-domain density functional theory.

Duncan WR, Prezhdo OV. Duncan WR, et al. Among authors: prezhdo ov. J Am Chem Soc. 2008 Jul 30;130(30):9756-62. doi: 10.1021/ja800268x. Epub 2008 Jul 1. J Am Chem Soc. 2008. PMID: 18593123

5

Ab initio nonadiabatic molecular dynamics of wet-electrons on the TiO(2) surface.

Fischer SA, Duncan WR, Prezhdo OV. Fischer SA, et al. Among authors: prezhdo ov. J Am Chem Soc. 2009 Oct 28;131(42):15483-91. doi: 10.1021/ja906599b. J Am Chem Soc. 2009. PMID: 19780540

6

Ab initio nonadiabatic molecular dynamics of the ultrafast electron injection from a PbSe quantum dot into the TiO2 surface.

Long R, Prezhdo OV. Long R, et al. Among authors: prezhdo ov. J Am Chem Soc. 2011 Nov 30;133(47):19240-9. doi: 10.1021/ja2085806. Epub 2011 Nov 7. J Am Chem Soc. 2011. PMID: 22007727

7

Photo-induced charge separation across the graphene-TiO2 interface is faster than energy losses: a time-domain ab initio analysis.

Long R, English NJ, Prezhdo OV. Long R, et al. Among authors: prezhdo ov. J Am Chem Soc. 2012 Aug 29;134(34):14238-48. doi: 10.1021/ja3063953. Epub 2012 Aug 21. J Am Chem Soc. 2012. PMID: 22880690

8

Ab initio time-domain study of the triplet state in a semiconducting carbon nanotube: intersystem crossing, phosphorescence time, and line width.

Habenicht BF, Prezhdo OV. Habenicht BF, et al. Among authors: prezhdo ov. J Am Chem Soc. 2012 Sep 26;134(38):15648-51. doi: 10.1021/ja305685v. Epub 2012 Sep 17. J Am Chem Soc. 2012. PMID: 22967091

9

Extremely long nonradiative relaxation of photoexcited graphane is greatly accelerated by oxidation: time-domain ab initio study.

Nelson TR, Prezhdo OV. Nelson TR, et al. Among authors: prezhdo ov. J Am Chem Soc. 2013 Mar 6;135(9):3702-10. doi: 10.1021/ja400033g. Epub 2013 Feb 20. J Am Chem Soc. 2013. PMID: 23373957

10

Defects are needed for fast photo-induced electron transfer from a nanocrystal to a molecule: time-domain ab initio analysis.

Long R, English NJ, Prezhdo OV. Long R, et al. Among authors: prezhdo ov. J Am Chem Soc. 2013 Dec 18;135(50):18892-900. doi: 10.1021/ja408936j. Epub 2013 Dec 6. J Am Chem Soc. 2013. PMID: 24279289

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