Otilia Mó

Publication Activity (10 Years)

Years Active: 1995-2024
Publications (10 Years): 4

Top Topics

Design Automation

Top Venues

J. Comput. Chem.

Publications

Otilia Mó, M. Merced Montero-Campillo, Manuel Yáñez, Ibon Alkorta, José Elguero
Discovering trends in the Lewis acidity of beryllium and magnesium hydrides and fluorides with increasing clusters size. J. Comput. Chem. 45 (20) (2024)
Otilia Mó, Al Mokhtar Lamsabhi, Jean-Claude Guillemin, Manuel Yáñez
Ionization, intrinsic basicity, and intrinsic acidity of unsaturated diols of astrochemical interest: 1,1- and 1,2-ethenediol: A theoretical survey. J. Comput. Chem. 45 (3) (2024)
Al Mokhtar Lamsabhi, M. Merced Montero-Campillo, Otilia Mó, Manuel Yáñez
A Theoretical Survey of the UV-Visible Spectra of Axially and Peripherally Substituted Boron Subphthalocyanines. Comput. 10 (2) (2022)
Al Mokhtar Lamsabhi, Soledad Gutiérrez-Oliva, Otilia Mó, Alejandro Toro-Labbé, Manuel Yáñez
Effects of the ionization in the tautomerism of uracil: A reaction electronic flux perspective. J. Comput. Chem. 36 (28) (2015)
Otilia Mó, Al Mokhtar Lamsabhi, Manuel Yáñez, Gavin S. Heverly-Coulson, Russell J. Boyd
Dramatic substituent effects on the mechanisms of nucleophilic attack on Se - S bridges. J. Comput. Chem. 34 (29) (2013)
Al Mokhtar Lamsabhi, Otilia Mó, Soledad Gutiérrez-Oliva, Patricia Pérez, Alejandro Toro-Labbé, Manuel Yáñez
The mechanism of double proton transfer in dimers of uracil and 2-thiouracil - The reaction force perspective. J. Comput. Chem. 30 (3) (2009)
Manuel Alcamí, Otilia Mó, Manuel Yáñez
G2 ab initio calculations on three-membered rings: Role of hydrogen atoms. J. Comput. Chem. 19 (9) (1998)
Leticia González, Otilia Mó, Manuel Yáñez
High-level ab initio versus DFT calculations on (H2O2)2 and H2O2-H2O complexes as prototypes of multiple hydrogen bond systems. J. Comput. Chem. 18 (9) (1997)
Antonio L. Llamas-Saiz, Concepción Foces-Foces, Otilia Mó, Manuel Yáñez, Eric Elguero, José Elguero
Geometry of Pyrazole: A Test for Ab Initio Calculations. J. Comput. Chem. 16 (3) (1995)