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Existence of minimizers for the Dirac-Fock model of crystals

Authors :
Catto, Isabelle
Meng, Long
Paturel, Eric
Séré, Eric
Source :
Archive for Rational Mechanics and Analysis 248 (2024), issue 4, article 63
Publication Year :
2022

Abstract

Whereas many different models exist in the mathematical and physics literature for ground states of non-relativistic crystals, the relativistic case has been much less studied and we are not aware of any mathematical result on a fully relativistic treatment of crystals. In this paper, we introduce a mean-field relativistic energy for crystals in terms of periodic density matrices. This model is inspired both from a recent definition of the Dirac-Fock ground state for atoms and molecules, due to one of us, and from the non-relativistic Hartree-Fock model for crystals. We prove the existence of a ground state when the number of electrons per cell is not too large.

Details

Database :
arXiv
Journal :
Archive for Rational Mechanics and Analysis 248 (2024), issue 4, article 63
Publication Type :
Report
Accession number :
edsarx.2212.01142
Document Type :
Working Paper
Full Text :
https://doi.org/10.1007/s00205-024-01988-8