Publication | Open Access
Guaranteed Convergence of a Regularized Kohn-Sham Iteration in Finite Dimensions
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Citations
28
References
2019
Year
Mathematical ProgrammingNumerical AnalysisFinite DimensionsEngineeringGeneralized FunctionPhysicsVariational AnalysisPde-constrained OptimizationRegularization (Mathematics)Quantum Field TheoryUniversal Lieb FunctionalGeneralized Density-functional TheoryFunctional AnalysisAdaptive Damping StepGeometric QuantizationApproximation TheoryInfinite Dimensional ProblemConvergence Analysis
The exact Kohn-Sham iteration of generalized density-functional theory in finite dimensions with a Moreau-Yosida regularized universal Lieb functional and an adaptive damping step is shown to converge to the correct ground-state density.
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