Theoretical chemistry and its applications

The present manuscript aims at gathering the modeling calculation tools available in the GAUSSIAN software, which are essential for the understanding of quantum chemistry. Simple examples of molecules, reactions, reaction mechanisms have been treated in order to focus the practical work on the methods and techniques of calculations. All the data necessary to solve the problems of chemical reactivity, geometry of molecules, etc. have been presented in this book. Finally, I hope that this manuscript will be a serious addition to the learning and success of the students.

About the author

Sameh Ayadiest docteur en chimie et maître assistante en chimie à la Faculté desSciences de Bizerte, Tunisie. En 2012, elle a eu le diplômed¿habilitation universitaire en chimie. Elle est également chercheur aulaboratoire des matériaux, molécules et applications à l¿université de Carthage (Tunisie)

Product details

• Authors: Sameh Ayadi
• Publisher: Our Knowledge Publishing
• Languages: English
• Product format: Paperback / Softback
• Released: 01.01.2021
• EAN: 9786203835175
• ISBN: 9786203835175
• No. of pages: 52
• Subjects: Natural sciences, medicine, IT, technology > Chemistry; Non-fiction book > Nature, technology > Natural science