Intermolecular complexes : the role of van der Waals systems in physical chemistry and in the biodisciplines
著者
書誌事項
Intermolecular complexes : the role of van der Waals systems in physical chemistry and in the biodisciplines
（Studies in physical and theoretical chemistry, v. 52）
Elsevier : Distribution for the U.S.A. and Canada Elsevier Science Publishing Co., 1988
- : est.
- タイトル別名
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Mezimolekulové komplexy
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注記
Translation of: Mezimolekulové komplexy
Includes index and bibliography
内容説明・目次
内容説明
Intermolecular complexes play an important role in physical chemistry, molecular physics and, especially, in the biodisciplines. In the early 1980s, rapid and significant progress was made in both experimental and theoretical investigations of molecular interactions - a fact which encouraged the authors to prepare this monograph. The coverage of the subject is particularly comprehensive, ranging from theory to experiment, from interactions of small systems to very large systems, as well as interactions of large numbers of systems, and from chemical to biological applications. The book is written for students and scientists working in various areas of chemistry, biology and physics. They will appreciate the fact that quantum and other theories of molecular interactions, experimental investigations of molecular interactions, and applications in physical chemistry and biodisciplines are consistently covered within a single book. Different computational techniques are analysed and concrete recommendations of computational strategy made for the treatment of van der Waals systems of various size.
目次
I. Introduction. The hierarchy of interactions between elementary particles, atoms and molecules. The origin and phenomenological description of weak interactions. Classification of van der Waals systems. Survey of published monographs and reviews. II. Methods of Calculating Weak Interactions. General consideration of the usefulness of various types of quantum chemical and other methods. Methods of calculating accurate (nonrelativistic) energies. The Hartree-Fock (SCF) method. Empirical methods. The molecular electrostatic potential (MEP) and field (MEF). Statistical thermodynamic treatment. Molecular dynamics and the Monte Carlo Method. III. Experimental Methods Yielding Information on Weak Intermolecular Interactions. Survey of methods. Elastic scattering in molecular beams. Spectroscopic methods. Bulk properties and transport phenomena. IV. Applications in Molecular Physics and Chemistry. The physical properties of individual van der Waals molecules. The reactivity of van der Waals molecules. V. Applications in the Biodisciplines. Nonbonding intramolecular and intermolecular interactions in large molecules. Important processes. Important and common characteristic of bioreactions. Interactions between selected systems. Notes on the mechanism of selected processes. References. Appendix. Index.
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