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.

This comprehensive reference/text provides a "how-to" approach to the Demonstrates cutting-edge applications in actinide chemistry, catalysi Written by leading researchers in the field, Computational Organometal lic Chemistry is an outstanding reference for organometallic, computat ional, inorganic, organic, medicinal, and materials chemists; and indu strial researchers; and an invaluable and informative text for upper-l evel undergraduate and graduate students in these disciplines.