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Molecular Response Functions for the Polarizable Continuum Model
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Molecular Response Functions for the Polarizable Continuum Model

This Brief presents the main aspects of the response functions theory (RFT) for molecular solutes described within the framework of the Polarizable Continuum Model (PCM). PCM is a solvation model for a Quantum Mechanical molecular system in which the solvent is represented as a continuum distribution of matter. Particular attention is devoted to the description of the basic features of the PCM model, and to the problems characterizing the study of the response function theory for molecules in solution with respect to the analogous theory on isolated molecules.
Alaotsikko
Physical basis and quantum mechanical formalism
Kirjailija
Roberto Cammi
Painos
2013 ed.
ISBN
9783319009865
Kieli
englanti
Paino
310 grammaa
Julkaisupäivä
23.10.2013
Sivumäärä
58