Annual Reports on Computational Chemistry
| Autor: | David A. Dixon |
|---|---|
| EAN: | 9780323990936 |
| eBook Format: | ePUB/PDF |
| Sprache: | Englisch |
| Produktart: | eBook |
| Veröffentlichungsdatum: | 05.11.2022 |
| Kategorie: | |
| Schlagworte: | Amine boranes BN dative bond energies Born?Oppenheimer CCSD(T) CCSDT(Q) CCSDTQ Catalysis Chemical accuracy Complete basis set limit Composite ab initio methods Computational thermochemistry Continuum solvent Core-valance Correlation-cons |
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Annual Reports in Computational Chemistry, Volume 18 in this important serial, highlights new advances in the field, with this new volume presenting interesting chapters on a variety of timely topics, including Atomistic modelling of surface plasmon resonances, Recent Advances in Solvation Modelling Applications: Chemical Properties, Reaction Mechanisms and Catalysis, Entropy considerations in catalysis, High level computational chemistry methods, and Computational Organofluorine chemistry. - Provides the authority and expertise of leading contributors from an international board of authors - Presents the latest release in the Annual Report on Computational Chemistry series - Covers topics ranging from atomistic modeling of surface plasmon resonances to computational organofluorine chemistry
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