Physical, Theoretical & Computational

Computational Modeling of d- and f-Block Chemistry: Challenges and Opportunities (#130)

This symposium focuses on the application and development of theoretical methods for the treatment of d- and f-block metal chemistry. Presentations will focus upon recent areas of emphasis in the field, including d- and f-block catalysis, the magnetic and photochemical properties of f-block molecules, and methodological development of relevance to these metals, especially where the complexities arising from the d- and f-electrons result in not only interesting chemistry, but also challenges in accurate modeling of these species. Bonding, structure, reactivity, and spectroscopy of these different subsets of d- and f-block metal compounds will be included in the symposium.
Last update: Dec 28, 2015