Structure and energetics of hydrogen clusters : structure of H1+1 and H1+3 : vibrational frequencies and infrared intensities of the H2+n+1 clusters (n=2-6)
ContributorsFarizon, Michel; Chermette, Henry; Farizon-Mazuy, Bernadette
Published inThe Journal of chemical physics, vol. 96, no. 2, p. 1325-1332
Publication date1992
Abstract
Keywords
- Hydrogen
- Atomic clusters
- Scf calculations
- Hartree−
- Fock method
- Ab initio calculations
- Configuration interaction
- Optimization
- Molecular structure
- Dissociation energy
- Size effect
- Harmonics
- Vibrational states
- Infrared spectra
Affiliation entities
Research groups
Citation (ISO format)
FARIZON, Michel, CHERMETTE, Henry, FARIZON-MAZUY, Bernadette. Structure and energetics of hydrogen clusters : structure of H1+1 and H1+3 : vibrational frequencies and infrared intensities of the H2+n+1 clusters (n=2-6). In: The Journal of chemical physics, 1992, vol. 96, n° 2, p. 1325–1332. doi: 10.1063/1.462168