Elfi Kraka

Chemical Bonds without Bonding Electron Density — Does the Difference Electron‐Density Analysis Suffice for a Description of the Chemical Bond?

Dieter Cremer, Elfi Kraka · Angewandte Chemie International Edition in English · 1984 · 1.5K citations

Electron Density, Chemical Bonds, Engineering +12

A Description of the Chemical Bond in Terms of Local Properties of Electron Density and Energy

Dieter Cremer, Elfi Kraka · Croatica Chemica Acta · 1984 · 654 citations

Electron Density, Local Properties, Engineering +9

Description of conjugation and hyperconjugation in terms of electron distributions

R. F. W. Bader, Tom Slee, Dieter Cremer et al. · Journal of the American Chemical Society · 1983 · 630 citations

Molecular Sciences, Engineering, Physics +15

An Accurate Description of the Bergman Reaction Using Restricted and Unrestricted DFT:  Stability Test, Spin Density, and On-Top Pair Density

Jürgen Gräfenstein, Angelica Hjerpe, Elfi Kraka et al. · The Journal of Physical Chemistry A · 2000 · 251 citations

Spin Density, Engineering, Physics +14

Theoretical determination of molecular structure and conformation. 15. Three-membered rings: bent bonds, ring strain, and surface delocalization

Dieter Cremer, Elfi Kraka · Journal of the American Chemical Society · 1985 · 238 citations

Materials Science, Crystal Structure, Surface Delocalization +14