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Halogen bonding versus hydrogen bonding: A molecular orbital perspective
Lando P. Wolters
,
F. Matthias Bickelhaupt
Vrije Universiteit Amsterdam
Research output
:
Contribution to journal
›
Review article
›
peer-review
235
Citations (Scopus)
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Keyphrases
Bond-based
25%
Bonding Mechanism
25%
BP86
25%
Charge Distribution
25%
Classical Electrostatics
25%
Computational Analysis
25%
Consistent Data
25%
Deformation Density
25%
Density Analysis
25%
Electrostatic Force
25%
Energy Decomposition Analysis
25%
Halogen Bond
100%
HOMO-LUMO Interaction
25%
Hydrogen Bond (H-bond)
100%
Hydrogen-bonded Complexes
25%
Kohn-Sham
25%
Lone Pair
25%
Molecular Orbital
100%
Molecular Orbital Theory
25%
Physical Model
25%
Regular Approximation
25%
Relativistic Density Functional Theory
25%
Trihalides
25%
Voronoi
25%
Chemistry
Ab Initio Calculation
33%
Charge Distribution
33%
Density Functional Theory
33%
Electrostatic Force
33%
Halogen
100%
Halogen Bonding
100%
Hydrogen
33%
Hydrogen Bonding
100%
Lowest Unoccupied Molecular Orbital
33%
Models (Physical)
33%
Molecular Orbital
100%