Literature DB >> 19518802

Downfolded self-energy of many-electron systems.

F Aryasetiawan1, J M Tomczak, T Miyake, R Sakuma.   

Abstract

Starting from the full many-body Hamiltonian of interacting electrons the effective self-energy acting on electrons residing in a subspace of the full Hilbert space is derived. This subspace may correspond to, for example, partially filled narrow bands, which often characterize strongly correlated materials. The formalism delivers naturally the frequency-dependent effective interaction (the Hubbard U) and provides a general framework for constructing theoretical models based on the Green's function language. It also furnishes a general scheme for first-principles calculations of complex systems in which the main correlation effects are concentrated on a small subspace of the full Hilbert space.

Year:  2009        PMID: 19518802     DOI: 10.1103/PhysRevLett.102.176402

Source DB:  PubMed          Journal:  Phys Rev Lett        ISSN: 0031-9007            Impact factor:   9.161


  1 in total

1.  Reduced Scaling of Optimal Regional Orbital Localization via Sequential Exhaustion of the Single-Particle Space.

Authors:  Guorong Weng; Mariya Romanova; Arsineh Apelian; Hanbin Song; Vojtěch Vlček
Journal:  J Chem Theory Comput       Date:  2022-07-11       Impact factor: 6.578

  1 in total

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