Regla Ayala
Instituto de Ciencia de Materiales de Sevilla(ES)Centro de Investigaciones Científicas Isla de la Cartuja(ES)Universidad de Sevilla(ES)
Publications by Year
Research Areas
Spectroscopy and Quantum Chemical Studies, Chemical and Physical Properties in Aqueous Solutions, Free Radicals and Antioxidants, Photochemistry and Electron Transfer Studies, Advanced Chemical Physics Studies
Most-Cited Works
- → Theoretical Study of the Microsolvation of the Bromide Anion in Water, Methanol, and Acetonitrile: Ion−Solvent vs Solvent−Solvent Interactions(2000)76 cited
- → Geometry and Hydration Structure of Pt(II) Square Planar Complexes [Pt(H2O)4]2+ and [PtCl4]2- as Studied by X-ray Absorption Spectroscopies and Quantum-Mechanical Computations(2001)74 cited
- → On the halide hydration study: Development of first-principles halide ion-water interaction potential based on a polarizable model(2003)66 cited
- → A Classical Point Charge Model Study of System Size Dependence of Oxidation and Reorganization Free Energies in Aqueous Solution(2007)58 cited
- → Development of first-principles interaction model potentials. An application to the study of the bromide hydration(2002)41 cited
- → Redox free energies and one-electron energy levels in density functional theory based ab initio molecular dynamics