Guaranteed Convergence of a Regularized Kohn-Sham Iteration in Finite Dimensions
arXiv:1903.09579 · doi:10.1103/PhysRevLett.123.037401
Abstract
The exact Kohn-Sham iteration of generalized density-functional theory in finite dimensions witha Moreau-Yosida regularized universal Lieb functional and an adaptive damping step is shown toconverge to the correct ground-state density.
arXiv comment3 figures, contains erratum with additional author Paul E. Lammert
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