On hybridization and bonding in the alkaline earths: Be, Mg, and Ca
- Charles W. Bauschlicher Jr.
- Paul S. Bagus
- et al.
- 1982
- The Journal of Chemical Physics
Paper
Publications
188 results for P.S. Bagus
The potential surface of NCNO
- Cecilia Björkman
- Paul S. Bagus
- 1982
- The Journal of Chemical Physics
PaperThe stability of RbH2O and RbHF: A Hartree-Fock study
- J.Q. Broughton
- P.S. Bagus
- 1982
- The Journal of Chemical Physics
PaperAdsorption of molecular nitrogen on nickel. I. Cluster-model theoretical studies
- K. Hermann
- P.S. Bagus
- et al.
- 1981
- Physical Review B
PaperAdsorption of molecular nitrogen on nickel. II. Comparison of photoemission for N2/Ni(100) to CO/Ni(100) and to theory
- C.R. Brundle
- P.S. Bagus
- et al.
- 1981
- Physical Review B
Paper3d-Valence orbital structure of Zn-phthalocyanine; results from photoemission experiments and cluster calculations
- E.E. Koch
- M. Iwan
- et al.
- 1981
- Chemical Physics
PaperAdsorption and surface penetration of atomic hydrogen at the open site of Si(111): An ab initio cluster-model study
- M. Seel
- P.S. Bagus
- 1981
- Physical Review B
PaperMolecular-orbital cluster-model study of the core-level spectrum of CO adsorbed on copper
- P.S. Bagus
- M. Seel
- 1981
- Physical Review B
PaperElectronic structure of transition-metal hydrides: NiH and PdH
- Paul S. Bagus
- Cecilia Björkman
- 1981
- Physical Review A
PaperA hybrid method for improving MCSCF convergence
- Charles W. Bauschlicher Jr.
- Paul S. Bagus
- et al.
- 1981
- The Journal of Chemical Physics
Paper