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Molecular Modeling of Inorganic Compounds

Molecular Modeling of Inorganic Compounds by Peter Comba
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After the second edition introduced first density functional theory aspects, this third edition expands on this topic and offers unique practice in molecular mechanics calculations and DFT. In addition, the tutorial with its interactive exercises has been completely revised and uses the very latest software, a full version of which is enclosed on CD, allowing readers to carry out their own initial experiments with forcefield calculations in organometal and complex chemistry.
Wiley; July 2009
346 pages; ISBN 9783527628131
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Title: Molecular Modeling of Inorganic Compounds
Author: Peter Comba; Trevor W. Hambley; Bodo Martin
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