The role of density functional theory in chemistry: Some historical landmarks and applications to zeolites
ContributorsCorminboeuf, Anne-Clémence; Tran, Fabien; Weber, Jacques
Published inJournal of molecular structure. Theochem, vol. 762, no. 1-3, p. 1-7
Publication date2006
Abstract
Keywords
- Density functional theory
- Historical landmarks
- Zeolites
- Magnetic properties
- A. Goursot contributions
Affiliation entities
Research groups
Citation (ISO format)
CORMINBOEUF, Anne-Clémence, TRAN, Fabien, WEBER, Jacques. The role of density functional theory in chemistry: Some historical landmarks and applications to zeolites. In: Journal of molecular structure. Theochem, 2006, vol. 762, n° 1-3, p. 1–7. doi: 10.1016/j.theochem.2005.07.036
Main files (1)
Article (Published version)
Identifiers
- PID : unige:3647
- DOI : 10.1016/j.theochem.2005.07.036
Journal ISSN0166-1280
