Comparison of perturbatively corrected MRD CI results with a full CI treatment of the BH ground state

Chemical Physics Letters

Volumn 95, Issue 4-5, 1983, Pages 379-385

  Burton, Peter G ^a   Buenker, Robert J ^b   Bruna, Pablo J ^c   Peyerimhoff, Sigrid D ^c  

^a UNIVERSITY OF WOLLONGONG   (Australia)

^b UNIVERSITY OF WUPPERTAL   (Germany)

^c UNIVERSITY OF BONN   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000896038     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/0009-2614(83)80578-8     Document Type: Article

References (26)

1. Ab Initio Calculations Close to the Full CI Lebel of Accuracy and their Use for the Interpretation of Molecular Spectra
2. The Unitary Group and the Electron Correlation Problem
3. Gaussian Basis Functions for Use in Molecular Calculations. IV. The Representation of Polarization Functions for the First Row Atoms and Hydrogen
4. Applicability of the multi-reference double-excitation CI (MRD-CI) method to the calculation of electronic wavefunctions and comparison with related techniques
5. Current aspects of Quantum Chemistry 1981
6. Configuration interaction calculations on the nitrogen molecule
7. A semi-empiricalMO theory for ionization potentials and electron affinities
8. Intern J. Quantum Chem.
9. Orbital correlation effects II. Potential curve and ionization potential of boron hydride