Björn O. Roos – författare
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3 produkter
3 produkter
Inbunden, Engelska, 2016
1 367 kr
Skickas inom 5-8 vardagar
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.
Häftad, Engelska, 1992
1 504 kr
Skickas inom 10-15 vardagar
Quantum Chemistry
Häftad, Engelska, 1994
1 397 kr
Skickas inom 10-15 vardagar
The second volume of Lecture Notes in Quantum Chemistry includes lectures in Hartree-Fock theory, density functional theory, coupled-cluster methods, and relativistic quantum chemistry. It also contains a problem section with solutions covering the subjects of both volumes. The two volumes constitute part of the course material of the European Summer Schools in Quantum Chemistry, organized in Sweden, every second year. The lecture notes have been written by outstanding scientists and teachers who participate in the education of students and young scientists. Taken together, the two volumes become an excellent teaching material for University courses in Theoretical Chemistry.