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.

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39 results for Charles W. Bauschlicher

A proposal for the proper use of pseudopotentials in molecular orbital cluster model studies of chemisorption
- - Paul S. Bagus
  - Charles W. Bauschlicher Jr.
  - et al.
- 1984
- The Journal of Chemical Physics
The metal-carbonyl bond in Ni(CO)₄ and Fe(CO)₅: A clear-cut analysis
- - Charles W. Bauschlicher Jr.
  - Paul S. Bagus
- 1984
- The Journal of Chemical Physics
On the nature of the bonding of lone pair ligands to a transition metal
- - Paul S. Bagus
  - Klaus Hermann
  - et al.
- 1984
- The Journal of Chemical Physics
NiNO. A model for NO on a metal surface
- - Charles W. Bauschlicher Jr.
  - Paul S. Bagus
- 1984
- The Journal of Chemical Physics
Bonding of CO to metal surfaces: A new interpretation
- - Paul S. Bagus
  - Constance J. Nelin
  - et al.
- 1983
- Physical Review B
On the nature of the low-lying states of TiO
- - Charles W. Bauschlicher Jr.
  - Paul S. Bagus
  - et al.
- 1983
- Chemical Physics Letters
Charging and hybridization in the finite cluster model
- - Charles W. Bauschlicher Jr.
  - Paul S. Bagus
  - et al.
- 1983
- Chemical Physics Letters
The convergence of the cluster model for the study of chemisorption: Be₃₆H
- - Paul S. Bagus
  - Henry F. Schaefer III
  - et al.
- 1983
- The Journal of Chemical Physics
An ab initio study of core-valence correlation
- - Harry Partridge
  - Charles W. Bauschlicher Jr.
  - et al.
- 1983
- The Journal of Chemical Physics
On the low-lying states of CuO
- - Paul S. Bagus
  - Constance J. Nelin
  - et al.
- 1983
- The Journal of Chemical Physics