Publications

188 results for P.S. Bagus

Singlet–triplet splittings as obtained from the Xα‐scattered wave method: A theoretical analysis
- - P.S. Bagus
  - B.I. Bennett
- 2004
- International Journal of Quantum Chemistry
Molecular orbital cluster model study of bonding and vibrations of CO adsorbed on MgO surface
- - Gianfranco Pacchioni
  - Giuseppe Cogliandro
  - et al.
- 2004
- International Journal of Quantum Chemistry
Covalent and ionic contributions to the bonding of atomic and molecular adsorbates on metal surfaces: A cluster model approach
- - G. Pacchioni
  - P.S. Bagus
  - et al.
- 2004
- International Journal of Quantum Chemistry
Hyperfine interactions in the 5d transition series
- - A.J. Freeman
  - J.V. Mallow
  - et al.
- 2003
- Journal of Applied Physics
Localized and delocalized 1s hole states of the O₂⁺ molecular ion
- - Paul S. Bagus
  - Henry F. Schaefer III
- 2003
- The Journal of Chemical Physics
Accuracy of numerical hartree-fock wavefunctions for heavy atoms
- - Paul S. Kelly
  - Oscar R. Platas
  - et al.
- 2003
- The Journal of Chemical Physics
Lowest ⁵Σ⁺ state of FeO: An ab initio investigation
- - P.S. Bagus
  - H.J.T. Preston
- 2003
- Journal of Chemical Physics
Accurate ab initia calculation of the BeH molecule. I. the X ²Σ⁺ and A²∏ states
- - P.S. Bagus
  - C. Moser
  - et al.
- 2003
- The Journal of Chemical Physics
⁷Σ⁺ and⁷∏ states of manganese hydride
- - Paul S. Bagus
  - Henry F. Schaefer III
- 2003
- The Journal of Chemical Physics
Use of nonrelativistic wavefunctions for the prediction of properties of molecules containing atoms of high Z. PbO as a test case
- - Gretchen M. Schwenzer
  - Dean H. Liskow
  - et al.
- 2003
- The Journal of Chemical Physics