Rothlisberger U - Search Results

1

Nonadiabatic effects in electronic and nuclear dynamics.

Bircher MP, Liberatore E, Browning NJ, Brickel S, Hofmann C, Patoz A, Unke OT, Zimmermann T, Chergui M, Hamm P, Keller U, Meuwly M, Woerner HJ, Vaníček J, Rothlisberger U. Bircher MP, et al. Among authors: rothlisberger u. Struct Dyn. 2018 Jan 9;4(6):061510. doi: 10.1063/1.4996816. eCollection 2017 Nov. Struct Dyn. 2018. PMID: 29376108 Free PMC article. Review.

2

Electron localization dynamics in the triplet excited state of [Ru(bpy)3]2+ in aqueous solution.

Moret ME, Tavernelli I, Chergui M, Rothlisberger U. Moret ME, et al. Among authors: rothlisberger u. Chemistry. 2010 May 25;16(20):5889-94. doi: 10.1002/chem.201000184. Chemistry. 2010. PMID: 20432417

3

Simulations of X-ray absorption spectra: the effect of the solvent.

Penfold TJ, Curchod BF, Tavernelli I, Abela R, Rothlisberger U, Chergui M. Penfold TJ, et al. Among authors: rothlisberger u. Phys Chem Chem Phys. 2012 Jul 14;14(26):9444-50. doi: 10.1039/c2cp24080g. Epub 2012 May 29. Phys Chem Chem Phys. 2012. PMID: 22644432

4

A wavelet analysis for the X-ray absorption spectra of molecules.

Penfold TJ, Tavernelli I, Milne CJ, Reinhard M, El Nahhas A, Abela R, Rothlisberger U, Chergui M. Penfold TJ, et al. Among authors: rothlisberger u. J Chem Phys. 2013 Jan 7;138(1):014104. doi: 10.1063/1.4772766. J Chem Phys. 2013. PMID: 23298025

5

Trajectory-based nonadiabatic dynamics with time-dependent density functional theory.

Curchod BF, Rothlisberger U, Tavernelli I. Curchod BF, et al. Among authors: rothlisberger u. Chemphyschem. 2013 May 10;14(7):1314-40. doi: 10.1002/cphc.201200941. Chemphyschem. 2013. PMID: 23625831

6

Probing the electronic and geometric structure of ferric and ferrous myoglobins in physiological solutions by Fe K-edge absorption spectroscopy.

Lima FA, Penfold TJ, van der Veen RM, Reinhard M, Abela R, Tavernelli I, Rothlisberger U, Benfatto M, Milne CJ, Chergui M. Lima FA, et al. Among authors: rothlisberger u. Phys Chem Chem Phys. 2014 Jan 28;16(4):1617-31. doi: 10.1039/c3cp53683a. Phys Chem Chem Phys. 2014. PMID: 24317683 Free article.

7

A quantum dynamics study of the ultrafast relaxation in a prototypical Cu(I)-phenanthroline.

Capano G, Chergui M, Rothlisberger U, Tavernelli I, Penfold TJ. Capano G, et al. Among authors: rothlisberger u. J Phys Chem A. 2014 Oct 23;118(42):9861-9. doi: 10.1021/jp509728m. Epub 2014 Oct 14. J Phys Chem A. 2014. PMID: 25275666

8

Lessons from nature: computational design of biomimetic compounds and processes.

Bozkurt E, Ashari N, Browning N, Brunk E, Campomanesa P, Perez MA, Rothlisberger U. Bozkurt E, et al. Among authors: rothlisberger u. Chimia (Aarau). 2014 Sep;68(9):642-7. doi: 10.2533/chimia.2014.642. Chimia (Aarau). 2014. PMID: 25437785 Free article.

9

Photooxidation and photoaquation of iron hexacyanide in aqueous solution: A picosecond X-ray absorption study.

Reinhard M, Penfold TJ, Lima FA, Rittmann J, Rittmann-Frank MH, Abela R, Tavernelli I, Rothlisberger U, Milne CJ, Chergui M. Reinhard M, et al. Among authors: rothlisberger u. Struct Dyn. 2014 Apr 17;1(2):024901. doi: 10.1063/1.4871751. eCollection 2014 Mar. Struct Dyn. 2014. PMID: 26798775 Free PMC article.

10

Ultrafast Relaxation Dynamics of the Ethylene Cation C(2)H(4)+.

Ludwig A, Liberatore E, Herrmann J, Kasmi L, López-Tarifa P, Gallmann L, Rothlisberger U, Keller U, Lucchini M. Ludwig A, et al. Among authors: rothlisberger u. J Phys Chem Lett. 2016 May 19;7(10):1901-6. doi: 10.1021/acs.jpclett.6b00646. Epub 2016 May 10. J Phys Chem Lett. 2016. PMID: 27139223

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