Saddle point geometry and barrier height for H + F2 → HF + F
- 1 May 1974
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 60 (9) , 3707-3708
- https://doi.org/10.1063/1.1681595
Abstract
No abstract availableKeywords
This publication has 10 references indexed in Scilit:
- Barrier Height for the Exchange Reaction F + HF → FH + FProceedings of the National Academy of Sciences, 1974
- Monte Carlo calculations of reaction rates and energy distributions among reaction products. III. H+F2→ HF+F and D+F2→ DF+FThe Journal of Chemical Physics, 1973
- On the H+F2→HF+F reaction. An ab initio potential energy surfaceThe Journal of Chemical Physics, 1973
- Potential Energy Surface Including Electron Correlation for F + H 2 → FH + H: Refined Linear SurfaceScience, 1972
- Potential Energy Surface Including Electron Correlation for the Chemical F + H2 → FH + H I. Preliminary SurfaceThe Journal of Chemical Physics, 1972
- Gaussian Basis Functions for Use in Molecular Calculations. I. Contraction of (9s5p) Atomic Basis Sets for the First-Row AtomsThe Journal of Chemical Physics, 1970
- A Natural Orbital Based Energy Calculation for Helium Hydride and Lithium HydrideThe Journal of Physical Chemistry, 1966
- Gaussian-Type Functions for Polyatomic Systems. IThe Journal of Chemical Physics, 1965
- Self-Consistent Field Theory for Open Shells of Electronic SystemsReviews of Modern Physics, 1960
- A Correlation of Reaction RatesJournal of the American Chemical Society, 1955