Jesús Rodríguez‐Otero

Analysis of the performance of DFT-D, M05-2X and M06-2X functionals for studying π⋯π interactions

Daniela Josa, Jesús Rodríguez‐Otero, Enrique M. Cabaleiro‐Lago et al. · Chemical Physics Letters · 2012 · 104 citations

Engineering, Physics, Natural Sciences +9

Analysis of two cycloplatinated compounds derived from N-(4-methoxyphenyl)-.alpha.-benzoylbenzylidenamine. Comparison of the activity of these compounds with other isostructural cyclopalladated compounds

C. Navarro-Ranninger, I. López-Solera, J.M. Trigo Perez et al. · Journal of Medicinal Chemistry · 1993 · 96 citations

Computational study of the dissociation of H–X acids (X=F, Cl, Br, I) in water clusters

Enrique M. Cabaleiro‐Lago, José M. Hermida‐Ramón, Jesús Rodríguez‐Otero · The Journal of Chemical Physics · 2002 · 88 citations

Engineering, Water Clusters, Computational Chemistry +17

On the Nature of σ–σ, σ–π, and π–π Stacking in Extended Systems

Enrique M. Cabaleiro‐Lago, Jesús Rodríguez‐Otero · ACS Omega · 2018 · 82 citations · Full text

Criteria for the Elucidation of the Pseudopericyclic Character of the Cyclization of (<i>Z</i>)‐1,2,4,6‐Heptatetraene and Its Heterosubstituted Analogues: Magnetic Properties and Natural Bond Orbital Analysis

Jesús Rodríguez‐Otero, Enrique M. Cabaleiro‐Lago · Chemistry - A European Journal · 2003 · 65 citations

Magnetic Properties, Chemical Engineering, Engineering +12