Solvent Effects and Chemical Reactivity

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Éditeur :

Kluwer Academic Publishers


Paru le : 1996

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Description

This work presents an up-to-date view of theories, practical methods and applications of solvent effects and chemical reactivity in condensed phases. Subjects treated include continuum solvation models, the theoretical basis for the treatment of solvent effects in density functional theory, Monte Carlo simulations of chemical reactions in solution, DFT molecular dynamics simulations, crossing the transition state in solution, valence bond multi-state approach to chemical reactions in solution, quantum theory of solvent effects and chemical reactions. The approaches taken as well as the resulting findings are discussed in detail, thus covering a large part of the methodology currently used in this field.
Pages
n.c
Collection
n.c
Parution
1996
Marque
Kluwer Academic Publishers
EAN papier
0306469316
EAN PDF
0306469316

Informations sur l'ebook
Nombre pages copiables
1
Nombre pages imprimables
10
Taille du fichier
1445 Ko
Prix
246,28 €

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