Effects of electron correlations in a simple model for adiabatic electrochemical reactions: The general relationships

Citation
Am. Kuznetsov et Ig. Medvedev, Effects of electron correlations in a simple model for adiabatic electrochemical reactions: The general relationships, RUSS J ELEC, 37(4), 2001, pp. 335-340
Citations number
34
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
RUSSIAN JOURNAL OF ELECTROCHEMISTRY
ISSN journal
10231935 → ACNP
Volume
37
Issue
4
Year of publication
2001
Pages
335 - 340
Database
ISI
SICI code
1023-1935(200104)37:4<335:EOECIA>2.0.ZU;2-B
Abstract
General relationships for adiabatic free-energy surfaces (AFES) for electro chemical reactions of electron transfer are derived in the framework of exa ctly solvable model of the so-called surface molecule, which is a limiting case of Anderson's Hamiltonian and may be applied to transition metals. As opposed to earlier models for adiabatic reactions, the model exactly allows for the effects of electron-electron correlations. The obtained results co nstitute a basis for calculating AFES and plotting diagrams that correspond to different kinetic regimes of one- and two-electron processes.