Molecular response functions for the polarizable continuum model : physical basis and quantum mechanical formalism / Roberto Cammi.
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 distributio...
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| Online Access: |
Full Text (via Springer) |
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| Main Author: | |
| Format: | eBook |
| Language: | English |
| Published: |
Cham :
Springer,
2013.
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| Series: | SpringerBriefs in molecular science. Electrical and magnetic properties of atoms, molecules, and clusters,
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| Subjects: |
| Summary: | 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 (i) to the description of the basic features of the PCM model, and (ii) 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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| Physical Description: | 1 online resource (xvi, 58 pages) |
| Bibliography: | Includes bibliographical references and index. |
| ISBN: | 9783319009872 3319009877 3319009869 9783319009865 |
| ISSN: | 2191-5407. |
| Source of Description, Etc. Note: | Online resource; title from PDF title page (SpringerLink, viewed October 14, 2013) |