Ab initio study of the vibrational dependence of hyperfine coupling constants in the methyl, silyl, and formaldehyde anion radicals
- Y. Ellinger
- F. Pauzat
- et al.
- 2008
- The Journal of Chemical Physics
Publications
954 results at The Journal of Chemical Physics
The chemical dynamics of the reactions of O(3P) with saturated hydrocarbons. II. Theoretical model
- A.C. Luntz
- P. Andresen
- 2008
- The Journal of Chemical Physics
Trajectory studies of O+H2 reactions on fitted ab initio surfaces. II. Singlet case
- Reinhard Schinke
- William A. Lester Jr.
- 2008
- The Journal of Chemical Physics
Critical test of equation-of-motion-Green's function methods. II. Comparison with configuration interaction results
- Michael F. Herman
- K.F. Freed
- et al.
- 2008
- The Journal of Chemical Physics
Ab initio potential curve for Be2(1Σ g+) from the interacting correlated fragments method
- B. Liu
- A.D. McLean
- 2008
- The Journal of Chemical Physics
Monte Carlo studies of porphyrin in the Shpolskii matrix n-octane
- T.R. Koehler
- 2008
- The Journal of Chemical Physics
Contracted Gaussian basis sets for molecular calculations. I. Second row atoms, Z=11-18
- A.D. McLean
- G.S. Chandler
- 2008
- The Journal of Chemical Physics
Nonbonding intermolecular forces: The tetrathiafulvalene (TTF) dimer
- B.D. Silverman
- 2008
- The Journal of Chemical Physics
Light induced proton transfer in dihydroxyanthraquinone as studied by photochemical hole burning
- F. Drissler
- F. Graf
- et al.
- 2008
- The Journal of Chemical Physics
Proton-H2 scattering on an ab initio CI potential energy surface. I. Vibrational excitation at 10 eV
- R. Schinke
- M. Dupuis
- et al.
- 2008
- The Journal of Chemical Physics