Quantum chemical and molecular dynamics simulations for beginners
Auteur :
Mishra, Dhirendra Kumar / Paul, Nabendu / Das, Nipu Kumar / Kumar, Nikhil / Banerjee, Tamal
Éditeur :
Taylor & Francis Ltd
ISBN :
9781032619286
Date de publication :
23 déc. 2025
Dimensions :
23,4 x 15,6 cm
Langue :
Anglais
Pays d'origine :
Grande Bretagne
This book provides an in-depth exploration of the dynamic field of computational chemistry. Spanning seven meticulously crafted chapters, it begins by laying a solid foundation in quantum chemistry and electronic structure theory, introducing essential tools and software that underpin computational chemistry calculations.