Ab initio Dirac-Fock self-consistent field calculations for open-shell heavy-atom systems: bonding in AuH+ ion

Chemical Physics Letters

Volumn 194, Issue 4-6, 1992, Pages 481-484

  Ishikawa, Yasuyuki ^a   Malli, Gulzari L ^b   Pyper, N C ^b  

^a UNIVERSITY OF PUERTO RICO   (Puerto Rico)

^b SIMON FRASER UNIVERSITY   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0040128125     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/0009-2614(92)86087-X     Document Type: Article

References (23)

1. Relativistic effects in atoms, molecules and solids
2. Effective Potentials in Molecular Quantum Chemistry
3. Ab initio Fully Relativistic Molecular Calculations: Bonding in Gold Hydride
4. Relativistic effects in structural chemistry
5. Relativistic effects in gold chemistry. I. Diatomic gold compounds
6. Relativistic AB Initio Calculations of Interaction Energies: Formulation and Application to Ionic Solids
7. Relativistic self-consistent-field (RSCF) theory for closed-shell molecules
8. Relativistic self-consistent field (RSCF) theory for open-shell molecules
9. A perturbation theory approach to relativistic calculations