Concepedia

Charge Density Analysis

Charge Density Analysis is a quantitative method in crystallography that determines the spatial distribution of electrons within a crystalline solid to characterize metallic bonding and inform structure determination by revealing deviations from idealized atomic charge models.

1.2K

Publications

79.6K

Citations

3.2K

Authors

1K

Institutions

Publications per year

2017–2026

172

Parents

Publications

1.2K

A grid-based Bader analysis algorithm without lattice bias

Wenjie Tang, Edward Sanville, Graeme Henkelman · Journal of Physics Condensed Matter · 2009 · 7.5K citations

, , +12

Bonded-atom fragments for describing molecular charge densities

F. L. Hirshfeld · Theoretical Chemistry Accounts · 1977 · 6.9K citations

, , +14

Improved grid‐based algorithm for Bader charge allocation

Edward Sanville, S.D. Kenny, Roger Smith et al. · Journal of Computational Chemistry · 2007 · 4.2K citations · Full text

, , +13

Characterization of C-H-O Hydrogen Bonds on the Basis of the Charge Density

Uwe Koch, Paul L. A. Popelier · The Journal of Physical Chemistry · 1995 · 3.1K citations

, , +12

Accurate and efficient algorithm for Bader charge integration

The Journal of Chemical Physics · 2011 · 2K citations · Full text

, , +12

1–5 of 1.2K

Authors

3.2K

  1. TN
    Tayur N. Guru Row

    Indian Institute of Science Bangalore, India

    32 publications · 2K citations

    25

    h-index

  2. PL
    Peter Luger

    Freie Universität Berlin, Germany

    29 publications · 1.2K citations

    21

    h-index

  3. JO
    Jacob Overgaard

    Aarhus University, Denmark

    23 publications · 979 citations

    20

    h-index

  4. CJ
    Christian Jelsch

    Centre National de la Recherche Scientifique, France

    27 publications · 1.5K citations

    19

    h-index

  5. DS
    Dietmar Stalke

    University of Göttingen, Germany

    21 publications · 1K citations

    19

    h-index

1–5 of 3.2K

Institutions

1K

  1. Centre National de la Recherche Scientifique

    Paris, France

    30 h-index

    202 publications

    9.9K citations

  2. Indian Institute of Science Bangalore

    Bengaluru, India

    27 h-index

    103 publications

    5.9K citations

  3. Université de Lorraine

    Nancy, France

    23 h-index

    135 publications

    6.4K citations

  4. Aarhus University

    Aarhus, Denmark

    23 h-index

    101 publications

    4.5K citations

  5. University of Göttingen

    Göttingen, Germany

    22 h-index

    93 publications

    4.4K citations

  6. Laboratoire de Cristallographie, Résonance Magnétique et Modélisations

    Vandœuvre-lès-Nancy, France

    21 h-index

    101 publications

    3.5K citations

  7. Freie Universität Berlin

    Berlin, Germany

    20 h-index

    110 publications

    4.2K citations

  8. University at Buffalo, State University of New York

    Buffalo, United States

    17 h-index

    47 publications

    2.7K citations

1–8 of 1K

Venues

  1. The Journal of Physical Chemistry A

    69 publications · 3.2K citations

    32

    h-index

  2. 28

    h-index

  3. 27

    h-index

  4. Crystal Growth & Design

    34 publications · 1.4K citations

    24

    h-index

  5. Journal of the American Chemical Society

    JACS · 27 publications · 1.6K citations

    24

    h-index

1–5