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Gonzalez, Leticia
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ResearcherID: G-7770-2012
URL: http://www.researcherid.com/rid/G-7770-2012
Subject: Chemistry
Keywords: quantum chemistry; photophysics; photochemistry; quantum dynamics; molecular dynamics
ORCID: http://orcid.org/0000-0001-5112-794X
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My URLs: http://theochem.univie.ac.at
 
 

This list contains papers that I have authored.

publication(s)  
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1.  Title: Ab initio molecular dynamics relaxation and intersystem crossing mechanisms of 5-azacytosine.
 Author(s): Carlos Borin, Antonio; Mai, Sebastian; Marquetand, Philipp; et al.
 Source: Physical chemistry chemical physics : PCCP Volume: 19 Issue: 8 Pages: 5888-5894 Published: 2017-Feb-22
 DOI: 10.1039/c6cp07919a
added
19-Mar-17
2.  Title: An Asymmetric Redox Arylation: Chirality Transfer from Sulfur to Carbon through a Sulfonium [3,3]-Sigmatropic Rearrangement.
 Author(s): Kaldre, Dainis; Maryasin, Boris; Kaiser, Daniel; et al.
 Source: Angewandte Chemie (International ed. in English) Volume: 56 Issue: 8 Pages: 2212-2215 Published: 2017-Feb-13
 DOI: 10.1002/anie.201610105
added
19-Mar-17
3.  Title: Molecular oxygen observed by direct photoproduction from carbon dioxide
 Author(s): Larimian, S.; Erattupuzha, S.; Mai, S.; et al.
 Source: Physical Review A Volume: 95 Issue: 1 Pages: 011404 (5 pp.) Published: Jan. 2017
 DOI: 10.1103/PhysRevA.95.011404
added
19-Mar-17
4.  Title: Sequential Proton-Coupled Electron Transfer Mediates Excited-State Deactivation of a Eumelanin Building Block.
 Author(s): Nogueira, Juan J; Corani, Alice; El Nahhas, Amal; et al.
 Source: The journal of physical chemistry letters Volume: 8 Issue: 5 Pages: 1004-1008 Published: 2017-Mar-02
 DOI: 10.1021/acs.jpclett.6b03012
added
19-Mar-17
5.  Title: The {IPEA} dilemma in {CASPT}2
 Author(s): J. Patrick Zobel; Juan J. Nogueira; Leticia Gonz{\'{a}}lez
 Source: Chem. Sci. Published: 2017
 DOI: 10.1039/C6SC03759C
added
19-Mar-17
6.  Title: Benzophenone Ultrafast Triplet Population: Revisiting the Kinetic Model by Surface-Hopping Dynamics
 Author(s): Marazzi, Marco; Mai, Sebastian; Roca-Sanjuan, Daniel; et al.
 Source: Journal of Physical Chemistry Letters Volume: 7 Issue: 4 Pages: 622-626 Published: FEB 18 2016
 Times Cited: 8
 DOI: 10.1021/acs.jpclett.5b02792
added
16-Jun-16
7.  Title: Challenges in Simulating Light-Induced Processes in DNA
 Author(s): Philipp Marquetand; Juan Nogueira; Sebastian Mai; et al.
 Source: Molecules Published: 2016
 DOI: 10.3390/molecules22010049
added
19-Mar-17
8.  Title: Chemo- and Stereoselective Transition-Metal-Free Amination of Amides with Azides
 Author(s): Tona, Veronica; de la Torre, Aurelien; Padmanaban, Mohan; et al.
 Source: Journal of the American Chemical Society Volume: 138 Issue: 27 Pages: 8348-8351 Published: JUL 13 2016
 Times Cited: 12
 DOI: 10.1021/jacs.6b04061
added
20-Oct-16
9.  Title: Communication: GAIMS-Generalized Ab Initio Multiple Spawning for both internal conversion and intersystem crossing processes
 Author(s): Curchod, Basile F. E.; Rauer, Clemens; Marquetand, Philipp; et al.
 Source: Journal of Chemical Physics Volume: 144 Issue: 10 Published: MAR 14 2016
 Times Cited: 7
 DOI: 10.1063/1.4943571
added
16-Jun-16
10.  Title: Communication: Unambiguous comparison of many-electron wavefunctions through their overlaps
 Author(s): Felix Plasser; Leticia Gonz{\'{a}}lez
 Source: The Journal of Chemical Physics Volume: 145 Issue: 2 Pages: 021103 Published: 2016
 Times Cited: 1
 DOI: 10.1063/1.4958462
added
19-Mar-17
publication(s)  
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