Article ID Journal Published Year Pages File Type
5374654 Chemical Physics 2011 8 Pages PDF
Abstract
► We outline a self-consistent density functional approach to the calculation of transition energies. ► The approach is an improvement over a previous scheme [Ziegler et al. Chem. Phys. 130, 154102 (2009)]. ► We describe how our method is related to other schemes based on density functional theory.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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