Recent publications (2011-2012)

1
F. FEIXAS, E. MATITO, M. DURAN, M. SOLA & B. SILVI.
Electron Localization Function at the Correlated Level: A Natural Orbital Formulation (vol 6, pg 2736, 2010).
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 7(4), 1231 (2011).

2
B. SILVI & L. A. ERIKSSON.
Special Issue: Proceedings from the Fourth Biophysics Symposium Introduction.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 111(6, SI), 1127 (2011).

3
W. BENCHOUK, S. M. MEKELLECHE, B. SILVI, M. J. AURELL & L. R. DOMINGO.
Understanding the kinetic solvent effects on the 1,3-dipolar cycloaddition of benzonitrile N-oxide: a DFT study.
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 24(7), 611-618 (2011).

4
A. SANCHEZ-GONZALEZ, S. MELCHOR, J. A. DOBADO, B. SILVI & J. ANDRES.
N, P, and As Ylides and Aza- and Arsa-Wittig Reactions from Topological Analyses of Electron Density.
JOURNAL OF PHYSICAL CHEMISTRY A, 115(29), 8316-8326 (2011).

5
A. M. YAREMKO, V. V. KOROTEEV, V. O. YUKHYMCHUK, V. M. DZHAGAN, H. RATAJCZAK, A. J. BARNES & B. SILVI.
Many particle approach to resonance Raman scattering in crystals: Strong electron-phonon interaction and multi-phonon processes.
CHEMICAL PHYSICS, 388(1-3), 57-68 (2011).

6
B. SILVI & P. REINHARDT.
Localization and Localizability in Quantum Organic Chemistry: Localized Orbitals and Localization Functions.
CURRENT ORGANIC CHEMISTRY, 15(20), 3555-3565 (2011).

7
J. ANDRES, S. BERSKI, L. R. DOMINGO, V. POLO & B. SILVI.
Describing the Molecular Mechanism of Organic Reactions by Using Topological Analysis of Electronic Localization Function.
CURRENT ORGANIC CHEMISTRY, 15(20), 3566-3575 (2011).

8
B. S. . J. M. R. J. CONTRERAS-GARCÍA, M. MARQUÉS.
Bonding changes along solid-solid phase transitions using the electron localization function approach.
In C. Gatti & P. Macchi (eds.), Modern Charge-Density Analysis, 625-658 (Springer-Verlag, Berlin, 2012).


Résumé