Concepedia

SCDM-k: Localized orbitals for solids via selected columns of the density matrix

Anil Damle, Lin Lin, Lexing Ying

Journal of Computational Physics · 2017 · 63 citations · 24 references

DOIFull text

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Concepts

References

24

Special points for Brillouin-zone integrations

Hendrik J. Monkhorst, J.D. Pack · Physical review. B, Solid state · 1976 · 70.3K citations

, , +6

Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 63.2K citations · Full text

, , +15

Maximally localized generalized Wannier functions for composite energy bands

Nicola Marzari, David Vanderbilt · Physical review. B, Condensed matter · 1997 · 4.8K citations · Full text

, , +9

Theory of polarization of crystalline solids

R. D. King-Smith, David Vanderbilt · Physical review. B, Condensed matter · 1993 · 4.4K citations

, , +15

Maximally localized Wannier functions: Theory and applications

Nicola Marzari, Arash A. Mostofi, Jonathan R. Yates et al. · Reviews of Modern Physics · 2012 · 3.3K citations · Full text

, , +17