Localized density matrix minimization and linear-scaling algorithms
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Publication:2375178
DOI10.1016/j.jcp.2016.02.076zbMath1349.82007arXiv1506.01610OpenAlexW2209479101MaRDI QIDQ2375178
Publication date: 5 December 2016
Published in: Journal of Computational Physics (Search for Journal in Brave)
Full work available at URL: https://arxiv.org/abs/1506.01610
Numerical optimization and variational techniques (65K10) Quantum equilibrium statistical mechanics (general) (82B10) Numerical linear algebra (65F99)
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Orbital minimization method with \(\ell^{1}\) regularization, Localization in Matrix Computations: Theory and Applications, A brief introduction to manifold optimization, Numerical methods for Kohn–Sham density functional theory
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Cites Work
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