A zero-order wave function of a dimer is defined as the antisymmetrized product of monomer Hartree᎐Fock wave functions. A symmetry-adapted many-body perturbation theory is developed up to the third order to obtain interaction energies at the Hartree᎐Fock level. Correlation effects are accounted for
✦ LIBER ✦
Hartree-Fock and many body perturbation theory with correlated realistic NN interactions
✍ Scribed by Roth, R.; Papakonstantinou, P.; Paar, N.; Hergert, H.; Neff, T.; Feldmeier, H.
- Book ID
- 126667685
- Publisher
- The American Physical Society
- Year
- 2006
- Tongue
- English
- Weight
- 264 KB
- Volume
- 73
- Category
- Article
- ISSN
- 0556-2813
No coin nor oath required. For personal study only.
📜 SIMILAR VOLUMES
Third-order many-body perturbation theor
✍
Péter R. Surján; C. Pérez Del Valle; Luis Lain
📂
Article
📅
1997
🏛
John Wiley and Sons
🌐
English
⚖ 190 KB
Many-body perturbation theory with a res
✍
Walter J. Lauderdale; John F. Stanton; Jürgen Gauss; John D. Watts; Rodney J. Ba
📂
Article
📅
1991
🏛
Elsevier Science
🌐
English
⚖ 550 KB
Restricted Hartree-Fock and unrestricted
✍
Petr Čársky; Ivan Hubač
📂
Article
📅
1991
🏛
Springer
🌐
English
⚖ 936 KB
Analytic evaluation of second derivative
✍
John F. Stanton; Jürgen Gauss; Rodney J. Bartlett
📂
Article
📅
1992
🏛
Elsevier Science
🌐
English
⚖ 352 KB
Explicit spin-orbital equations are presented for the second derivative of the second-order many-body perturbation theory energy based on unrestricted Hartree-Fock reference functions, and their implementation is briefly discussed. Results are reported for the electric polarizabilities, harmonic vib
Configuration interaction (CI), coupled-
✍
Kizashi Yamaguchi
📂
Article
📅
1979
🏛
Elsevier Science
🌐
English
⚖ 421 KB
Correlation energy of open-shell systems
✍
Hubač, Ivan; Čársky, Petr
📂
Article
📅
1980
🏛
The American Physical Society
🌐
English
⚖ 315 KB