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Kniha Multiconfigurational Quantum Chemistry Bjorn Roos

Multiconfigurational Quantum Chemistry

Autor: Bjorn Roos
Jazyk: Angličtina
Väzba: Pevná
Vydavateľ: John Wiley & Sons Inc
Dostupnosť: Skladom u dodávateľa v malom množstve
Odosielame za 11-15 dní
120.12 €
The first book to aid in the understanding of multiconfigurational quantum chemistry, Multiconfigur...

Informácie o knihe

Autor
Bjorn Roos
Jazyk
Angličtina
Väzba
Kniha - Pevná
Vydalo
2016
Stránok
240
EAN
9780470633465
ISBN
0470633468
Enbook ID
04884885
Vydavateľ
John Wiley & Sons Inc
Hmotnosť
504
Rozmery
243 x 163 x 20

Kompletný popis

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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