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
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.