A theoretical study of the electronic structure of ferrocene and ferricinium: Application to Mössbauer isomer shifts, ionization potentials, and conformation
- P.S. Bagus
- U.I. Walgren
- et al.
- 2008
- The Journal of Chemical Physics
Publications
This is our catalog of publications authored by IBM researchers, in collaboration with the global research community. It’s an ever-growing body of work that shows why IBM is one of the most important contributors to modern computing.
Date
Featured collections
Popular topics
4 results for J. Almlof
Connected triple excitations in coupled-cluster calculations of hyperpolarizabilities: neon
- Julia E. Rice
- Gustavo E. Scuseria
- et al.
- 1992
- Chemical Physics Letters
The determination of accurate dipole polarizabilities α and γ for the noble gases
- Julia E. Rice
- Peter R. Taylor
- et al.
- 1991
- The Journal of Chemical Physics
The polarizabilities of neon
- Peter R. Taylor
- Timothy J. Lee
- et al.
- 1989
- Chemical Physics Letters