Molecular Modeling of Inorganic Compounds. Peter Comba
Прочая образовательная литература.
Molecular Modeling of Inorganic Compounds
Год выпуска 0
isbn 9783527628131
Автор произведения Peter Comba
Жанр Прочая образовательная литература
Издательство John Wiley & Sons Limited
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.