Computational Chemistry Methods

Applications

Computational Chemistry Methods

Applications

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This book reviews a variety of methods in computational chemistry and their applications in different fields of current research. Ab initio methods and regression analyses are discussed with special focus on their application to investigate chemical structures as for example dyes or drug compounds. Further topics are the use of computational methods in the modeling of spectroscopic data or to study reaction mechanisms.



Ponnadurai Ramasami, University of Mauritius, Mauritius, Indian Ocean.

ISBN 9783110629927
Artikelnummer 9783110629927
Medientyp E-Book - ePUB
Copyrightjahr 2020
Verlag Walter de Gruyter GmbH & Co.KG
Umfang 194 Seiten
Sprache Englisch
Kopierschutz Digitales Wasserzeichen