Spin-Dependent Density Functional Theory and Effective Yang–Mills Theory

Spin-dependent density functional theory provides a microscopic frameworkfor calculating the electronic, magnetic, and structural properties of condensedmatter systems. However, conventional spin-density functional theory does not always provide a fully gauge-covariant description of spatially varying spin textures, spin–orbit coupling, noncollinear magnetism, and topological electronic states.This paper proposes an effective Yang–Mills formulation of spin-dependent densityfunctional theory in which the electronic spinor is regarded as a matter field transforming under a local internal SU(2) symmetry. In this representation, spin–orbitinteraction, exchange fields, noncollinear magnetization, and geometric spin connections are incorporated into a generalized non-Abelian covariant derivative. The resulting theory introduces an SU(2) gauge potential Aµ, its non-Abelian curvatureFµν, and an effective Yang–Mills contribution to the energy functional.The central proposal is that the exchange-correlation energy should dependnot only on the scalar density n(r) and magnetization m(r), but also on gaugecovariant quantities such as Dµm, Fµν, and gauge-invariant combinations of thesefields. The framework may improve the description of spin-current transport, chiralmagnetic textures, skyrmions, spin–orbit-induced forces, topological phases, andmagnetoelastic coupling.

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Publication Details

Journal
Zenodo (CERN European Organization for Nuclear Research)
Published
2026-09-30
DOI
https://doi.org/10.5281/zenodo.23053585
Primary Topic
Topological Materials and Phenomena
Type
article
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Spin-Dependent Density Functional Theory and Effective Yang–Mills Theory

Khaled Aldhufri
Zenodo (CERN European Organization for Nuclear Research)
Topological Materials and Phenomena
article

Spin-Dependent Density Functional Theory and Effective Yang–Mills Theory

Khaled Aldhufri
article en

Abstract

Spin-dependent density functional theory provides a microscopic frameworkfor calculating the electronic, magnetic, and structural properties of condensedmatter systems. However, conventional spin-density functional theory does not always provide a fully gauge-covariant description of spatially varying spin textures, spin–orbit coupling, noncollinear magnetism, and topological electronic states.This paper proposes an effective Yang–Mills formulation of spin-dependent densityfunctional theory in which the electronic spinor is regarded as a matter field transforming under a local internal SU(2) symmetry. In this representation, spin–orbitinteraction, exchange fields, noncollinear magnetization, and geometric spin connections are incorporated into a generalized non-Abelian covariant derivative. The resulting theory introduces an SU(2) gauge potential Aµ, its non-Abelian curvatureFµν, and an effective Yang–Mills contribution to the energy functional.The central proposal is that the exchange-correlation energy should dependnot only on the scalar density n(r) and magnetization m(r), but also on gaugecovariant quantities such as Dµm, Fµν, and gauge-invariant combinations of thesefields. The framework may improve the description of spin-current transport, chiralmagnetic textures, skyrmions, spin–orbit-induced forces, topological phases, andmagnetoelastic coupling.

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