Chemistry with ADF
Abstract We present the theoretical and technical foundations of the Amsterdam Density Functional (ADF) program with a survey of the characteristics of the code (numerical integ...
Publications
2 shownUnderstanding reactivity with Kohn-Sham molecular orbital theory: E2-SN2 mechanistic spectrum and other concepts
On the basis of Kohn–Sham density functional (DFT) investigations on elementary organic and organometallic reactions, we show how a detailed understanding of the electronic stru...
Frequent Co-Authors
Researcher Info
- h-index
- 2
- Publications
- 2
- Citations
- 10,437
- Institution
- Vrije Universiteit Amsterdam
External Links
Identifiers
- ORCID
- 0000-0003-4655-7747
Impact Metrics
h-index
2
h-index: Number of publications with at least h citations each.