KnihyOdborné a náučnéMolecular Modeling of Inorganic Compounds

Molecular Modeling of Inorganic Compounds

After the second edition introduced first density functional theory aspects, this third edition expands on this topic and offers unique practice in molecular mechanics... Čítať viac

Vydavateľstvo: Wiley-Blackwell, 2009

Počet strán: 344

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... Čítať viac

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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.

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