The Schrödinger equation for strongly interacting electron-transfer systems is described, the eigenvalues depending on a dielectric polarization function P(r) for the medium, on the internal coordinates q, and, when the electron transfer is coupled to a dissociation, on a generalized coordinate Q. A choice of the reaction coordinate for the variation of P(r), q, and Q, so as to reach the saddle-point, and the calculation of the free energy of activation are described. The question of suitable data on the solvent dependence of strong-overlap systems is also considered
In this paper we present a general theoretical-computational model for treating electron transfer re...
This paper deals with the theory of point interactions for the one-dimensional Schrödinger equation....
A microscopic theory of outersphere electron transfer reactions in electrolyte solutions is presente...
The Schrödinger equation for strongly interacting electron-transfer systems is described, the eigenv...
Solvent effects play a major role in controlling electron-transfer reactions. The solvent dynamics h...
We report microscopic calculations of free energies and entropies for intramolecular electron transf...
To solve the equation of motion for a quantum-mechanical wavefunction $\psi$ the Schrödinger equati...
A microscopic theory of outersphere electron transfer reactions occurring in mixed dipolar liquids i...
The theory of simple electron transfers at electrodes and in solution is reviewed, and various therm...
Data on electron exchange reactions have provided insight into factors influencing rates of electron...
There is general agreement that the two most important factors determining electron transfer rates i...
In this paper we give some ideas that can be useful to solve Schrödinger equations in the case when ...
The Coulombic coupling of electric dipole (E1) transition moments is the most commonly studied and w...
Recent decades have seen remarkable advances in microscopic understanding of electron transfer (ET) ...
A theoretical model is presented aimed to provide a detailed microscopic description of the electron...
In this paper we present a general theoretical-computational model for treating electron transfer re...
This paper deals with the theory of point interactions for the one-dimensional Schrödinger equation....
A microscopic theory of outersphere electron transfer reactions in electrolyte solutions is presente...
The Schrödinger equation for strongly interacting electron-transfer systems is described, the eigenv...
Solvent effects play a major role in controlling electron-transfer reactions. The solvent dynamics h...
We report microscopic calculations of free energies and entropies for intramolecular electron transf...
To solve the equation of motion for a quantum-mechanical wavefunction $\psi$ the Schrödinger equati...
A microscopic theory of outersphere electron transfer reactions occurring in mixed dipolar liquids i...
The theory of simple electron transfers at electrodes and in solution is reviewed, and various therm...
Data on electron exchange reactions have provided insight into factors influencing rates of electron...
There is general agreement that the two most important factors determining electron transfer rates i...
In this paper we give some ideas that can be useful to solve Schrödinger equations in the case when ...
The Coulombic coupling of electric dipole (E1) transition moments is the most commonly studied and w...
Recent decades have seen remarkable advances in microscopic understanding of electron transfer (ET) ...
A theoretical model is presented aimed to provide a detailed microscopic description of the electron...
In this paper we present a general theoretical-computational model for treating electron transfer re...
This paper deals with the theory of point interactions for the one-dimensional Schrödinger equation....
A microscopic theory of outersphere electron transfer reactions in electrolyte solutions is presente...