Multi-Center Electronic Structure Calculations for Plasma Equation of State
Description:
We report on an approach for computing electronic structure utilizing solid-state multi-center scattering techniques, but generalized to finite temperatures to model plasmas. This approach has the advantage of handling mixtures at a fundamental level without the imposition of ad hoc continuum lowering models, and incorporates bonding and charge exchange, as well as multi-center effects in the calculation of the continuum density of states.
Date:
December 14, 2010
Creator:
Wilson, B. G.; Johnson, D. D. & Alam, A.
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