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Strategies and Applications in Quantum Chemistry: From Molecular Astrophysics to Molecular Engineering (Topics in Molecular Organization and Engineering, Band 14) - Softcover

 
9789401737869: Strategies and Applications in Quantum Chemistry: From Molecular Astrophysics to Molecular Engineering (Topics in Molecular Organization and Engineering, Band 14)
Softcover
ISBN 10: 940173786X ISBN 13: 9789401737869
Verlag: Springer, 2013

Inhaltsangabe

At the time when increasing numbers of chemists are being attracted by the fascination of supposedly easy computing and associated colourful imaging, this book appears as a counterpoint.
The first part focuses on fundamental concepts of quantum chemistry, covering MCSCF theory, perturbation treatments, basis set developments, density matrices, wave function instabilities to correlation effects, and momentum space theory.
The second part is devoted to more practical studies, ranging from the characterisation of exotic interstellar molecules, the accurate determination of spectroscopic constants, excited states structures and EPR parameters through photochemical and charge-transfer processes, cluster chemistry and fullerenes, muonium chemistry, to the possible prediction of the response of materials to electric fields in view of nonlinear optical applications.
Audience: Graduate students and researchers whose work involves quantum chemistry, molecular physics, and materials modelling.

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Verlag
Springer
Erscheinungsdatum
2013
Sprache
Englisch
ISBN 10 
940173786X
ISBN 13 
9789401737869
Einband
Taschenbuch
Anzahl der Seiten
480
Herausgeber
Ellinger Y., Defranceschi M.
Kontakt zum Hersteller
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