Concepedia

Electronic Parameterization

Electronic Parameterization is a formal systematic method within the domain of electronic effects that quantifies and characterizes the influence of electronic properties on molecular behavior through defined numerical or categorical descriptors.

208

Publications

11.5K

Citations

631

Authors

290

Institutions

Publications per year

2017–2026

24

Parents

Publications

208

Optimization of parameters for semiempirical methods VI: more modifications to the NDDO approximations and re-optimization of parameters

James J. P. Stewart · Journal of Molecular Modeling · 2012 · 2K citations · Full text

, , +15

Fast, efficient generation of high-quality atomic charges. AM1-BCC model: I. Method

Araz Jakalian, Bruce L. Bush, D. B. Jack et al. · Journal of Computational Chemistry · 2000 · 1.6K citations

, , +10

Difluorphos, an Electron‐Poor Diphosphane: A Good Match Between Electronic and Steric Features

Séverine Jeulin, Sébastien Duprat de Paule, Virginie Ratovelomanana‐Vidal et al. · Angewandte Chemie International Edition · 2003 · 255 citations

, , +12

Geometrical substituent parameters for benzene derivatives: inductive and resonance effects

Aldo Domenicano, Peter Murray‐Rust · Tetrahedron Letters · 1979 · 222 citations

, , +16

Optimized statistical exchange parameters ? for atoms with higherZ

Karlheinz Schwarz · Theoretical Chemistry Accounts · 1974 · 184 citations

, , +5

1–5 of 208

Authors

631

  1. ME
    Marcus Elstner

    Karlsruhe Institute of Technology, Germany

    3 publications · 228 citations

    3

    h-index

  2. BT
    Brian T. Sutcliffe

    University of York, United Kingdom

    3 publications · 245 citations

    3

    h-index

  3. KJ
    Karl Jug

    Leibniz University Hannover, Germany

    3 publications · 177 citations

    3

    h-index

  4. PN
    P. N. Skancke

    UiT The Arctic University of Norway, Norway

    3 publications · 101 citations

    3

    h-index

  5. IG
    Imre G. Csizmadia

    University of Toronto, Canada

    3 publications · 184 citations

    3

    h-index

1–5 of 631

Institutions

290

  1. Centre National de la Recherche Scientifique

    Paris, France

    6 h-index

    13 publications

    673 citations

  2. Case Western Reserve University

    Cleveland, United States

    3 h-index

    4 publications

    137 citations

  3. Leibniz University Hannover

    Hanover, Germany

    3 h-index

    8 publications

    509 citations

  4. Charles University

    Prague, Czechia

    3 h-index

    11 publications

    369 citations

  5. University of Surrey

    Guildford, United Kingdom

    3 h-index

    6 publications

    64 citations

  6. Adam Mickiewicz University in Poznań

    Poznan, Poland

    3 h-index

    6 publications

    343 citations

  7. University of York

    York, United Kingdom

    3 h-index

    3 publications

    245 citations

  8. Courant Institute of Mathematical Sciences

    New York, United States

    2 h-index

    2 publications

    144 citations

1–8 of 290

Venues

  1. Chemical Physics Letters

    16 publications · 730 citations

    14

    h-index

  2. The Journal of Chemical Physics

    13 publications · 675 citations

    12

    h-index

  3. Theoretical Chemistry Accounts

    12 publications · 545 citations

    12

    h-index

  4. Journal of Molecular Structure

    9 publications · 178 citations

    9

    h-index

  5. Journal of Computational Chemistry

    7 publications · 1.9K citations

    7

    h-index

1–5