A density functional especially designed for hydrogen-only systems
ContributorsChermette, Henry; Razafinjanahary, Holy; Carrion, Lionel
Published inThe Journal of chemical physics, vol. 107, no. 24, p. 10643-10651
Publication date1997
Abstract
Keywords
- Hydrogen neutral atoms
- Hydrogen neutral molecules
- Dissociation energies
- Ab initio calculations
- Density functional theory
- Atom-molecule reactions
- Positive ions
Affiliation entities
Research groups
Citation (ISO format)
CHERMETTE, Henry, RAZAFINJANAHARY, Holy, CARRION, Lionel. A density functional especially designed for hydrogen-only systems. In: The Journal of chemical physics, 1997, vol. 107, n° 24, p. 10643–10651. doi: 10.1063/1.474180
