Concepedia

Kohn-sham Equations

The Kohn-Sham Equations is a theoretical framework within density functional theory that maps the many-body problem of interacting electrons into a fictitious system of non-interacting electrons moving in an effective potential, thereby enabling the calculation of electronic structure through self-consistent solutions of single-particle Schrödinger-like equations.

2.4K

Publications

417.8K

Citations

4K

Authors

1.3K

Institutions

Publications per year

2017–2026

346

Parents

Publications

2.4K

Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

Georg Kresse, J. Furthmüller · Physical review. B, Condensed matter · 1996 · 120.5K citations

, , +15

Self-Consistent Equations Including Exchange and Correlation Effects

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

, , +15

Density-Functional Theory for Time-Dependent Systems

Erich Runge, E. K. U. Gross · Physical Review Letters · 1984 · 8.8K citations

, , +14

Density-functional method for nonequilibrium electron transport

Mads Brandbyge, José-Luís Mozos, Pablo Ordejón et al. · Physical review. B, Condensed matter · 2002 · 5.8K citations · Full text

, , +17

Theory of polarization of crystalline solids

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

, , +15

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Authors

4K

  1. AG
    Andreas Görling

    Friedrich-Alexander-Universität Erlangen-Nürnberg, Germany

    37 publications · 3.2K citations

    26

    h-index

  2. EK
    E. K. U. Gross

    Max Planck Institute of Microstructure Physics, Germany

    31 publications · 13.3K citations

    25

    h-index

  3. EJ
    Evert Jan Baerends

    Vrije Universiteit Amsterdam, Netherlands

    28 publications · 4.9K citations

    24

    h-index

  4. JP
    John P. Perdew

    Tulane University, United States

    29 publications · 7K citations

    24

    h-index

  5. TH
    Trygve Helgaker

    University of Oslo, Norway

    22 publications · 2.5K citations

    20

    h-index

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Institutions

1.3K

  1. Centre National de la Recherche Scientifique

    Paris, France

    37 h-index

    134 publications

    8.1K citations

  2. Tulane University

    New Orleans, United States

    33 h-index

    83 publications

    22.6K citations

  3. Vrije Universiteit Amsterdam

    Amsterdam, The Netherlands

    32 h-index

    102 publications

    14K citations

  4. University of Cambridge

    Cambridge, United Kingdom

    26 h-index

    66 publications

    8.9K citations

  5. University of California, Irvine

    Irvine, United States

    26 h-index

    82 publications

    6.8K citations

  6. Duke University

    Durham, United States

    25 h-index

    64 publications

    5.9K citations

  7. University of North Carolina at Chapel Hill

    Chapel Hill, United States

    24 h-index

    45 publications

    7.8K citations

  8. Lawrence Berkeley National Laboratory

    Berkeley, United States

    24 h-index

    84 publications

    6.5K citations

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Venues

  1. The Journal of Chemical Physics

    325 publications · 32.4K citations

    85

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  2. Physical review. B, Condensed matter

    PRB · 172 publications · 151.8K citations

    67

    h-index

  3. Physical Review Letters

    PRL · 118 publications · 25.8K citations

    64

    h-index

  4. Physical Review A

    PRA · 158 publications · 12.6K citations

    55

    h-index

  5. Physical Review B

    PRB · 107 publications · 9.2K citations

    46

    h-index

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