Следене
Lluís Blancafort
Lluís Blancafort
Institute of Computational Chemistry and Department of Chemistry, University of Girona (UdG)
Потвърден имейл адрес: udg.edu - Начална страница
Заглавие
Позовавания
Позовавания
Година
Quantum Mechanical Studies on the Photophysics and the Photochemistry of Nucleic Acids and Nucleobases
R Improta, F Santoro, L Blancafort
Chemical reviews 116 (6), 3540-3593, 2016
5132016
Ultrafast decay of electronically excited singlet cytosine via a π, π* to no, π* state switch
N Ismail, L Blancafort, M Olivucci, B Kohler, MA Robb
Journal of the American Chemical Society 124 (24), 6818-6819, 2002
3562002
Triplet-state formation along the ultrafast decay of excited singlet cytosine
M Merchán, L Serrano-Andrés, MA Robb, L Blancafort
Journal of the American Chemical Society 127 (6), 1820-1825, 2005
2042005
Excited-state potential energy surface for the photophysics of adenine
L Blancafort
Journal of the American Chemical Society 128 (1), 210-219, 2006
1872006
A conical intersection model to explain aggregation induced emission in diphenyl dibenzofulvene
Q Li, L Blancafort
Chemical Communications 49 (53), 5966-5968, 2013
1722013
Theoretical study of benzotriazole UV photostability: Ultrafast deactivation through coupled proton and electron transfer triggered by a charge-transfer state
MJ Paterson, MA Robb, L Blancafort, AD DeBellis
Journal of the American Chemical Society 126 (9), 2912-2922, 2004
1692004
Restricted access to a conical intersection to explain aggregation induced emission in dimethyl tetraphenylsilole
XL Peng, S Ruiz-Barragan, ZS Li, QS Li, L Blancafort
Journal of Materials Chemistry C 4 (14), 2802-2810, 2016
1622016
Key role of a threefold state crossing in the ultrafast decay of electronically excited cytosine
L Blancafort, MA Robb
The Journal of Physical Chemistry A 108 (47), 10609-10614, 2004
1502004
Exploring Potential Energy Surfaces for Aggregation‐Induced Emission—From Solution to Crystal
R Crespo‐Otero, Q Li, L Blancafort
Chemistry–An Asian Journal 14 (6), 700-714, 2019
1412019
Mechanism of an exceptional class of photostabilizers: a seam of conical intersection parallel to excited state intramolecular proton transfer (ESIPT) in o-hydroxyphenyl-(1, 3 …
MJ Paterson, MA Robb, L Blancafort, AD DeBellis
The Journal of Physical Chemistry A 109 (33), 7527-7537, 2005
1342005
Through-space interaction of tetraphenylethylene: what, where, and how
J Liu, H Zhang, L Hu, J Wang, JWY Lam, L Blancafort, BZ Tang
Journal of the American Chemical Society 144 (17), 7901-7910, 2022
1332022
Singlet excited-state dynamics of 5-fluorocytosine and cytosine: An experimental and computational study
L Blancafort, B Cohen, PM Hare, B Kohler, MA Robb
The Journal of Physical Chemistry A 109 (20), 4431-4436, 2005
1302005
New algorithms for optimizing and linking conical intersection points
F Sicilia, L Blancafort, MJ Bearpark, MA Robb
Journal of Chemical Theory and Computation 4 (2), 257-266, 2008
1262008
Modeling thymine photodimerizations in DNA: mechanism and correlation diagrams
L Blancafort, A Migani
Journal of the American Chemical Society 129 (47), 14540-14541, 2007
1122007
CASSCF/CAS-PT2 study of hole transfer in stacked DNA nucleobases
L Blancafort, AA Voityuk
The Journal of Physical Chemistry A 110 (20), 6426-6432, 2006
1122006
Ultrafast above-threshold dynamics of the radical anion of a prototypical quinone electron-acceptor
DA Horke, Q Li, L Blancafort, JRR Verlet
Nature chemistry 5 (8), 711-717, 2013
1022013
Photophysics of the π, π* and n, π* States of Thymine: MS-CASPT2 Minimum-Energy Paths and CASSCF on-the-Fly Dynamics
D Asturiol, B Lasorne, MA Robb, L Blancafort
The Journal of Physical Chemistry A 113 (38), 10211-10218, 2009
1012009
Exploring the sloped-to-peaked S2/S1 seam of intersection of thymine with electronic structure and direct quantum dynamics calculations
D Asturiol, B Lasorne, GA Worth, MA Robb, L Blancafort
Physical Chemistry Chemical Physics 12 (19), 4949-4958, 2010
982010
Energetics of Cytosine Singlet Excited‐State Decay Paths—A Difficult Case for CASSCF and CASPT2†
L Blancafort
Photochemistry and photobiology 83 (3), 603-610, 2007
952007
Conical intersections: A perspective on the computation of spectroscopic Jahn–Teller parameters and the degenerate ‘intersection space’
MJ Paterson, MJ Bearpark, MA Robb, L Blancafort, GA Worth
Physical Chemistry Chemical Physics 7 (10), 2100-2115, 2005
952005
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