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Communication: Strong-interaction limit of an adiabatic connection in Hartree-Fock theory
- Source :
- Journal of Chemical Physics, 149(24):241101, 1-5. American Institute of Physics Publising LLC, Seidl, M, Giarrusso, S, Vuckovic, S, Fabiano, E & Gori-Giorgi, P 2018, ' Communication : Strong-interaction limit of an adiabatic connection in Hartree-Fock theory ', Journal of Chemical Physics, vol. 149, no. 24, 241101, pp. 1-5 . https://doi.org/10.1063/1.5078565, The Journal of Chemical Physics
- Publication Year :
- 2019
-
Abstract
- We show that the leading term in the strong-interaction limit of the adiabatic connection that has as weak-interaction expansion the Møller-Plesset perturbation theory can be fully determined from a functional of the Hartree-Fock density. We analyze this functional and highlight similarities and differences with the strong-interaction limit of the density-fixed adiabatic connection case of Kohn-Sham density functional theory.
- Subjects :
- Physics
010304 chemical physics
Strong interaction
Hartree–Fock method
General Physics and Astronomy
01 natural sciences
Term (time)
Connection (mathematics)
Quantum mechanics
0103 physical sciences
Physics::Atomic and Molecular Clusters
Density functional theory
Perturbation theory (quantum mechanics)
Limit (mathematics)
Physical and Theoretical Chemistry
010306 general physics
Adiabatic process
Subjects
Details
- ISSN :
- 10897690 and 00219606
- Volume :
- 149
- Issue :
- 24
- Database :
- OpenAIRE
- Journal :
- The Journal of chemical physics
- Accession number :
- edsair.doi.dedup.....c669f6e67b4dae520f25a1d5984e21a8
- Full Text :
- https://doi.org/10.1063/1.5078565