Multiconfigurational Quantum Chemistry


The first book to aid in the understanding of multiconfigurational quantum chemistry, Multiconfigurational Quantum Chemistry demystifies a subject that has historically been considered difficult to learn. Accessible to any reader with a background in quantum mechanics and quantum chemistry, the book contains illustrative examples showing how these methods can be used in various areas of chemistry, such as chemical reactions in ground and excited states, transition metal and other heavy element systems. The authors detail the drawbacks and limitations of DFT and coupled-cluster based methods and offer alternative, wavefunction-based methods more suitable for smaller molecules.
KES 20,172
International delivery
Free click & collect
UPC9781119277880
Author Björn O. Roos, Roland Lindh, Per �ke Malmqvist, Valera Veryazov, Per-Olof Widmark
Pages 240
Language English
Format EPUB
Publisher Wiley
SKU9781119277880
None

Reviews

Leave a product review
or cancel