Modeling of Covalent Bonding Interactions
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Donald Brenner
North Carolina State University
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This symposium will address the modeling and theory of covalent bonding interactions, as well as the practical application of such models. Advances in classical reactive potentials, such as bond-order potentials, will be featured prominently, along with state-of-the-art simulations using these models. Topics may also include advances in quantum mechanical models and their application. Contributed talks are welcomed in areas ranging from developments in ab initio modeling and high-level quantum mechanics calculations of covalent bonding to bond-order potential development and large-scale simulations of covalent processes in materials.
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SERMACS thanks the following for support of this symposium
Division of Physical Chemistry
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