List of QCEXVAL publications in 2007
- “Linear and Nonlinear Optical Properties of Some Organo-Xenon Derivatives”.
A. Avramopoulos, L. Serrano-Andrés, J. Li, H. Reis, and M. G. Papadopoulos,
Journal of Chemical Physics. 127, 214102 (2007) - “Bioexcimers as Precursors of Charge Transfer and Reactivity in Photobiology”.
L. Serrano-Andrés, M. Merchán, D. Roca-Sanjuán, G. Olaso-González, and M. Rubio
AIP Conference Proceedings. 963, 526-532 (2007) - “Ultrafast Electron Transfer in Photosynthesis: Reduced Pheophytin and Quinone Interaction Mediated by Conical Intersections”.
G. Olaso-González, M. Merchán, and L. Serrano-Andrés
AIP Conference Proceedings. 963, 706-709 (2007) - “Toward an Understanding of the Spectral Tuning in Rhodopsin”.
G. Olaso-González, G. Tomasello, P. Altoe, M. Stenta, L. Serrano-Andrés, M. Merchán, and M. Garavelli
AIP Conference Proceedings. 963, 710-712 (2007) - “Retinal Photoisomerization in Rhodopsin: Electrostatic and Steric Catalysis”.
G. Tomasello, P. Altoe, G. Olaso-González, M. Garavelli, and G. Orlandi
AIP Conference Proceedings. 963, 727-730 (2007) - “MOLCAS 7.0. A Quantum Chemistry Package”.
K. Andersson, F. Aquilante, M. Barysz, E. Bednarz, A. Bernhardsson, M. R .A. Blomberg, Y. Carissan, D. L. Cooper, M. Cossi, A. Devarajan, L. De Vico, N. Ferré, M. P. Fülscher, A. Gaenko, L. Gagliardi, G. Ghigo, C. de Graaf, B. A. Hess, D. Hagberg, A. Holt, G. Karlström, J. W. Krogh, R. Lindh, P.-A. Malmqvist, T. Nakajima, P. Neogrády, J. Olsen, T. B. Pedersen, J. Raab, M. Reiher, B. O. Roos, U. Ryde, B. Schimmelpfennig, M. Schütz, L. Seijo, L. Serrano-Andrés, P. E. M. Siegbahn, J. Stalring, T. Thorsteinsson, V. Veryazov, P.-O. Widmark, and A. Wolf.,
University of Lund, Lund, Sweden. (2007) - “On the Intrinsic Population of the Lowest Triplet State of Thymine”.
J. J. Serrano-Pérez, R. González-Luque, M. Merchán, and L. Serrano-Andrés,
Journal of Physical Chemistry B. 111, 11880-11883 (2007) - “Ultrafast Electron Transfer in Photosynthesis: Reduced Pheophytin and Quinone Interaction Mediated by Conical Intersections”.
G. Olaso-González, M. Merchán, and L. Serrano-Andrés
Photosynthesis Research. 91, 199-199 PS548 (2007) - “What is the Limit of Atom Encapsulation for Icosahedral Carboranes?”.
V. Manero, J. M. Oliva, L. Serrano-Andrés, and D. J. Klein
Journal of Chemical Theory and Computation. 3, 1399-1404 (2007) - “On the Intrinsic Population of the Lowest Triplet State of Uracil”.
T. Climent, R. González-Luque, M. Merchán, and L. Serrano-Andrés,
Chemical Physics Letters. 441, 327-331 (2007) - “Hydrogen transfer versus Proton Transfer in 7-Hydroxyquinoline (NH3) 3. A CASSCF/CASPT2 Study”
A. Fernández-Ramos, E. Martínez-Núñez, S. A. Vázquez, M. A. Ríos, C. Estévez, M. Merchán, and L. Serrano-Andrés
Journal of the Physical Chemistry A. 111, 5907-5912 (2007) - About the Intrinsic Photochemical Properties of the 11-cis Retinal Chromophore: Computational Clues for a Trap State and a Lever Effect in Rhodopsin Catalysis”.
A. Cembran, R. González-Luque, L. Serrano-Andrés, M. Merchán, and M. Garavelli
Theoretical Chemistry Accounts. 118, 173-183 (2007) - “Quantum Chemical Study on the Population of the Lowest Triplet State of Psoralen”.
J. J. Serrano-Pérez, M. Merchán, and L. Serrano-Andrés
Chemical Physics Letters. 434, 107-110 (2007)