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Multiconfigurational Quantum Chemistry

Language EnglishEnglish
E-book Adobe ePub DRM
Publishers John Wiley & Sons Inc, August 2016
The first book to aid in the understanding of multiconfigurational quantum chemistry, Multiconfigura... Full description
? points 332 b
135.88 €
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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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About the book

Full name Multiconfigurational Quantum Chemistry
Author Bj rn O. Roos, Roland Lindh, Per 'ke Malmqvist, Valera Veryazov, Per-Olof Widmark
Language English
Binding E-book - Adobe ePub DRM
Date of issue 2016
EAN 9781119277880
Libristo code 47350827
Publishers John Wiley & Sons Inc

Categories

Mathematics & Science > Chemistry > Physical chemistry > Quantum & theoretical chemistry
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