Some comments on the stability of Cu3: Ab initio self-consistent-field molecular-orbital calculations
- G. Del Conde
- P.S. Bagus
- et al.
- 1982
- Physical Review B
Publications
Date
Featured collections
Popular topics
188 results for P.S. Bagus
Multiple excitations and charge transfer in the ESCA N1s (NO2) spectrum of paranitroaniline. A theoretical and experimental study
- Hans Ågren
- Björn O. Roos
- et al.
- 1982
- The Journal of Chemical Physics
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
The stability of RbH2O and RbHF: A Hartree-Fock study
- J.Q. Broughton
- P.S. Bagus
- 1982
- The Journal of Chemical Physics
CI calculations on metallic and molecular hydrogen rings
- M. Seel
- P.S. Bagus
- et al.
- 1982
- The Journal of Chemical Physics
The potential surface of NCNO
- Cecilia Björkman
- Paul S. Bagus
- 1982
- The Journal of Chemical Physics
Adsorption of molecular nitrogen on nickel. I. Cluster-model theoretical studies
- K. Hermann
- P.S. Bagus
- et al.
- 1981
- Physical Review B
Adsorption 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
3d-Valence orbital structure of Zn-phthalocyanine; results from photoemission experiments and cluster calculations
- E.E. Koch
- M. Iwan
- et al.
- 1981
- Chemical Physics
Adsorption 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