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Книга Multiconfigurational Quantum Chemistry Bjorn Roos

Multiconfigurational Quantum Chemistry

Автор: Bjorn Roos
Език: Английски език
Корици: С твърди корици
Издател: John Wiley & Sons Inc
Наличност: Външен склад в ограничено количество
Изпращаме след 11-15 дни
132.55 € 259.25 лв
The first book to aid in the understanding of multiconfigurational quantum chemistry, Multiconfigur...

Информация за книгата

Автор
Bjorn Roos
Език
Английски език
Корици
Книга - С твърди корици
Издадена
2016
страници
240
EAN
9780470633465
ISBN
0470633468
Enbook ID
04884885
Издател
John Wiley & Sons Inc
Теглоt
504
Размери
243 x 163 x 20

Пълно описание

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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