Molecular Response Functions for the Polarizable Continuum Model : Physical basis and quantum mechanical formalism
2013 ed.
Book Details
Format
Paperback / softback
Book Series
SpringerBriefs in Molecular Science
ISBN-10
3319009869
ISBN-13
9783319009865
Edition
2013 ed.
Publisher
Springer International Publishing AG
Imprint
Springer International Publishing AG
Country of Manufacture
CH
Country of Publication
GB
Publication Date
Oct 23rd, 2013
Print length
58 Pages
Product Classification:
Materials / States of matterQuantum & theoretical chemistryQuantum and theoretical chemistry
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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).
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.
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