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most citedCP2K: An Electronic Structure and Molecular Dynamics Software Package -- Quickstep: Efficient and Accurate Electronic Structure Calculations

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cond-mat.str-el2016★ 9 cited

Adaptive cluster approximation for reduced density-matrix functional theory

Robert Schade, Peter E. Blöchl

A method, called the adaptive cluster approximation (ACA), for single-impurity Anderson models is proposed. It is based on reduced density-matrix functional theory, where the one-p…