Książka Multiconfigurational Quantum Chemistry Bjorn Roos

Multiconfigurational Quantum Chemistry

Autor: Bjorn Roos
Język: Angielski
Oprawa: Twarda
Dostępność: Dostępna u dostawcy w małych ilościach
Wysyłamy za 11-15 dni
538.94
The first book to aid in the understanding of multiconfigurational quantum chemistry, Multiconfigur...

Informacje o książce

Autor
Język
Angielski
Oprawa
Książka - Twarda
Data wydania
2016
strony
240
EAN
9780470633465
ISBN
0470633468
Enbook ID
04884885
Waga
504
Wymiary
243 x 163 x 20

Pełny opis

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.

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