This work provides a how-to approach to the fundamentals, methodologies and dynamics of computational organometallic chemistry, including classical and molecular mechanics (MM), quantum mechanics (QM), and hybrid MM/QM techniques. It demonstrates applications in actinide chemistry, catalysis, main group chemistry, medicine, and organic synthesis.
ISBN: | 9780824704780 |
Publication date: | 16th March 2001 |
Author: | Thomas R. Cundari |
Publisher: | CRC Press Inc an imprint of Taylor & Francis Inc |
Format: | Hardback |
Pagination: | 442 pages |
Genres: |
Life sciences: general issues Inorganic chemistry |