Mavros MG - Search Results

1

What can density functional theory tell us about artificial catalytic water splitting?

Mavros MG, Tsuchimochi T, Kowalczyk T, McIsaac A, Wang LP, Voorhis TV. Mavros MG, et al. Inorg Chem. 2014 Jul 7;53(13):6386-97. doi: 10.1021/ic5002557. Epub 2014 Apr 2. Inorg Chem. 2014. PMID: 24694041

2

Reactions of Persistent Carbenes with Hydrogen-Terminated Silicon Surfaces.

Zhukhovitskiy AV, Mavros MG, Queeney KT, Wu T, Voorhis TV, Johnson JA. Zhukhovitskiy AV, et al. Among authors: mavros mg. J Am Chem Soc. 2016 Jul 13;138(27):8639-52. doi: 10.1021/jacs.6b04962. Epub 2016 Jul 1. J Am Chem Soc. 2016. PMID: 27366818

3

Condensed phase electron transfer beyond the Condon approximation.

Mavros MG, Hait D, Van Voorhis T. Mavros MG, et al. J Chem Phys. 2016 Dec 7;145(21):214105. doi: 10.1063/1.4971166. J Chem Phys. 2016. PMID: 28799393

4

Communication: CDFT-CI couplings can be unreliable when there is fractional charge transfer.

Mavros MG, Van Voorhis T. Mavros MG, et al. J Chem Phys. 2015 Dec 21;143(23):231102. doi: 10.1063/1.4938103. J Chem Phys. 2015. PMID: 26696039

5

Addressable carbene anchors for gold surfaces.

Zhukhovitskiy AV, Mavros MG, Van Voorhis T, Johnson JA. Zhukhovitskiy AV, et al. Among authors: mavros mg. J Am Chem Soc. 2013 May 22;135(20):7418-21. doi: 10.1021/ja401965d. Epub 2013 May 13. J Am Chem Soc. 2013. PMID: 23668242

6

Resummed memory kernels in generalized system-bath master equations.

Mavros MG, Van Voorhis T. Mavros MG, et al. J Chem Phys. 2014 Aug 7;141(5):054112. doi: 10.1063/1.4891669. J Chem Phys. 2014. PMID: 25106575

7

A hybrid memory kernel approach for condensed phase non-adiabatic dynamics.

Hait D, Mavros MG, Van Voorhis T. Hait D, et al. Among authors: mavros mg. J Chem Phys. 2017 Jul 7;147(1):014108. doi: 10.1063/1.4990739. J Chem Phys. 2017. PMID: 28688393

8

Optical absorbance of doped Si quantum dots calculated by time-dependent density functional theory with partial electronic self-interaction corrections.

Freitag H, Mavros MG, Micha DA. Freitag H, et al. Among authors: mavros mg. J Chem Phys. 2012 Oct 14;137(14):144301. doi: 10.1063/1.4755995. J Chem Phys. 2012. PMID: 23061842

9

Mapping receptor density on live cells by using fluorescence correlation spectroscopy.

Chen Y, Munteanu AC, Huang YF, Phillips J, Zhu Z, Mavros M, Tan W. Chen Y, et al. Chemistry. 2009;15(21):5327-36. doi: 10.1002/chem.200802305. Chemistry. 2009. PMID: 19360825 Free PMC article.

10

Septipyridines as conformationally controlled substitutes for inaccessible bis(terpyridine)-derived oligopyridines in two-dimensional self-assembly.

Caterbow D, Künzel D, Mavros MG, Groß A, Landfester K, Ziener U. Caterbow D, et al. Among authors: mavros mg. Beilstein J Nanotechnol. 2011;2:405-15. doi: 10.3762/bjnano.2.46. Epub 2011 Jul 26. Beilstein J Nanotechnol. 2011. PMID: 22003448 Free PMC article.

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