The equation-of-motion coupled-cluster method: Excitation energies of Be and CO

Chemical Physics Letters

Volumn 164, Issue 1, 1989, Pages 57-62

  Geertsen, Jan ^a   Rittby, Magnus ^a   Bartlett, Rodney J ^a  

^a UNIVERSITY OF FLORIDA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 4243864319     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/0009-2614(89)85202-9     Document Type: Article

References (57)

1. Coupled-cluster approach to molecular structure and spectra: a step toward predictive quantum chemistry
2. Many-body perturbation theory, coupled-pair many-electron theory, and the importance of quadruple excitations for the correlation problem
3. Molecular Applications of Coupled Cluster and Many-Body Perturbation Methods
4. MBPT and coupled cluster calculation on the neon atom with numerical orbitals
5. A linear response, coupled-cluster theory for excitation energy
6. Time-dependent coupled cluster approach: Excitation energy calculation using an orthogonally spin-adapted formalism
7. Application of linear response theory in a coupled cluster framework for the calculation of ionization potentials
8. Cluster expansion of the wavefunction. The open-shell orbital theory including electron correlation
9. Aspects of linked cluster expansion in general model space many-body perturbation and coupled-cluster theory
10. Molecular applications of multireference coupled-cluster methods using an incomplete model space: Direct calculation of excitation energies
11. Direct calculation of excitation energies by the coupled-cluster method: Mg and Ar atoms
12. A coupled cluster polarization propagator method applied to CH+
13. Bound states of a many-particle system
14. Compound pair states in imperfect Fermi gases
15. On the Correlation Problem in Atomic and Molecular Systems. Calculation of Wavefunction Components in Ursell-Type Expansion Using Quantum-Field Theoretical Methods
16. Many-Body Perturbation Theory and Coupled Cluster Theory for Electron Correlation in Molecules
17. Polarization Propagator Calculations
18. Determination of excitation energies and transition moments in a second order polarization propagator approach. Application to the Be atom and the CH+ molecule
19. State vectors and propagators in many-electron theory. A unified approach
20. Polarization propagator calculations with an AGP reference state
21. Generalized Tamm–Dancoff approximation (GTDA) and random-phase approximation (GRPA) calculations on LiH, Be, and Li2
22. Application of graphical methods of spin algebras to limitedCI approaches. I. Closed shell case
23. Calculation of spectra and spin-spin coupling constants using a coupled-cluster polarization propagator method