Relativistic all-electron molecular Hartree-Fock-Dirac-(Breit) calculations on CH4, SiH4, GeH4, SnH4, PbH4

Theoretica Chimica Acta

Volumn 81, Issue 6, 1992, Pages 405-416

  Visser, O ^a   Visscher, L ^a   Aerts, P J C ^a   Nieuwpoort, W C ^a  

^a UNIVERSITY OF GRONINGEN   (Netherlands)

Author keywords

Breit interaction; Hartree Fock Dirac method; Relativistic ab initio calculations; Tetrahedral hydrides

Indexed keywords

EID: 8344290290     PISSN: 00405744     EISSN: 14322234     Source Type: Journal    
DOI: 10.1007/BF01134864     Document Type: Article

References (31)

1. Relativistic Quantum Chemistry
2. General contraction in four-component relativistic Hartree-Dock calculations
3. Open shell relativistic molecular Dirac-Hartree-Fock SCF-program
4. The Quantum Theory of the Electron
5. The Quantum Theory of the Electron. Part II
6. The Triplets of Helium
7. Basis set expansion of the dirac operator without variational collapse
8. General contraction of Gaussian atomic orbitals: Core, valence, polarization, and diffuse basis sets; Molecular integral evaluation
9. Gaussian basis sets for the fifth row elements, Mo-Cd, and the sixth row elements W-RN
10. The anharmonic force field and equilibrium structure of methane