Marquetand P - Search Results

1

Nonadiabatic Forward Flux Sampling for Excited-State Rare Events.

Reiner MM, Bachmair B, Tiefenbacher MX, Mai S, González L, Marquetand P, Dellago C. Reiner MM, et al. Among authors: marquetand p. J Chem Theory Comput. 2023 Mar 28;19(6):1657-1671. doi: 10.1021/acs.jctc.2c01088. Epub 2023 Mar 1. J Chem Theory Comput. 2023. PMID: 36856706 Free PMC article.

2

Local control theory applied to molecular photoassociation.

Marquetand P, Engel V. Marquetand P, et al. J Chem Phys. 2007 Aug 28;127(8):084115. doi: 10.1063/1.2762222. J Chem Phys. 2007. PMID: 17764237

3

Molecular dump processes induced by chirped laser pulses.

Marquetand P, Nuernberger P, Brixner T, Engel V. Marquetand P, et al. J Chem Phys. 2008 Aug 21;129(7):074303. doi: 10.1063/1.2960581. J Chem Phys. 2008. PMID: 19044763

4

Local control of the quantum dynamics in multiple potential wells.

Marquetand P, Gräfe S, Scheidel D, Engel V. Marquetand P, et al. J Chem Phys. 2006 Feb 7;124(5):054325. doi: 10.1063/1.2167066. J Chem Phys. 2006. PMID: 16468887

5

Additive polarizabilities in ionic liquids.

Bernardes CE, Shimizu K, Lopes JN, Marquetand P, Heid E, Steinhauser O, Schröder C. Bernardes CE, et al. Among authors: marquetand p. Phys Chem Chem Phys. 2016 Jan 21;18(3):1665-70. doi: 10.1039/c5cp06595j. Epub 2015 Dec 17. Phys Chem Chem Phys. 2016. PMID: 26675139

6

Stark control of a chiral fluoroethylene derivative.

Kinzel D, Marquetand P, González L. Kinzel D, et al. Among authors: marquetand p. J Phys Chem A. 2012 Mar 22;116(11):2743-9. doi: 10.1021/jp207947x. Epub 2011 Nov 9. J Phys Chem A. 2012. PMID: 22070542

7

Nonadiabatic ab initio molecular dynamics including spin-orbit coupling and laser fields.

Marquetand P, Richter M, González-Vázquez J, Sola I, González L. Marquetand P, et al. Faraday Discuss. 2011;153:261-73; discussion 293-319. doi: 10.1039/c1fd00055a. Faraday Discuss. 2011. PMID: 22452086

8

Singlet and triplet excited-state dynamics study of the keto and enol tautomers of cytosine.

Mai S, Marquetand P, Richter M, González-Vázquez J, González L. Mai S, et al. Among authors: marquetand p. Chemphyschem. 2013 Sep 16;14(13):2920-31. doi: 10.1002/cphc.201300370. Epub 2013 Jul 25. Chemphyschem. 2013. PMID: 23893944

9

Non-adiabatic and intersystem crossing dynamics in SO2. II. The role of triplet states in the bound state dynamics studied by surface-hopping simulations.

Mai S, Marquetand P, González L. Mai S, et al. Among authors: marquetand p. J Chem Phys. 2014 May 28;140(20):204302. doi: 10.1063/1.4875036. J Chem Phys. 2014. PMID: 24880275

10

Perturbational treatment of spin-orbit coupling for generally applicable high-level multi-reference methods.

Mai S, Müller T, Plasser F, Marquetand P, Lischka H, González L. Mai S, et al. Among authors: marquetand p. J Chem Phys. 2014 Aug 21;141(7):074105. doi: 10.1063/1.4892060. J Chem Phys. 2014. PMID: 25149773

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