Many-body perturbation theory for non-orthogonal basis states
- Publisher
- Elsevier Science
- Year
- 1969
- Tongue
- English
- Weight
- 176 KB
- Volume
- 7
- Category
- Article
- ISSN
- 0038-1098
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๐ SIMILAR VOLUMES
By efficiently combining coupled-cluster iterations with the 2 n + 1 rule of perturbation theory, we report full sixth-order MBPT. All terms are evaluated with a Hartree-Fock reference and the Moller-Plesset separation of the Hamiltonian and less than an n 9 procedure. The total correction correspon
Rece~~txl 1-l 31.1~ 1979; in final term 9 J ul) ! 979 .\ Ned rero-ord~r kumltonizm for mm) -hod) R&eigh-ScbGdingcr perturbation tbeor! is suggested\_ This operator contains the St&e;-Piesrct tend tpstein-Nesbet reference hamiltoninns .IS special CISCS. IltusrrsrRc calculntions arc preswted for the b
Although the physical significance of Kohn-Sham orbitals is only given by the ground state density of the Kohn-Sham quasi-particle system they nevertheless form a single-particle system, which may serve as a basis for perturbation theory or variational methods. Rayleigh-SchrSdinger perturbation seri