Gauge-invariant projector calculus for quantum state geometry and applications to observables in crystals

Fuente: arXiv
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Hauptverfasser: Mitscherling, Johannes, Avdoshkin, Alexander, Moore, Joel E.
Format: Preprint
Veröffentlicht: 2024
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author Mitscherling, Johannes
Avdoshkin, Alexander
Moore, Joel E.
author_facet Mitscherling, Johannes
Avdoshkin, Alexander
Moore, Joel E.
contents The importance of simple geometrical invariants, such as the Berry curvature and quantum metric, constructed from the Bloch states of a crystal has become well-established over four decades of research. More complex aspects of geometry emerge in properties linking multiple bands, such as optical responses. In the companion work [arXiv:2409.16358], we identified novel multi-state geometrical invariants using an explicitly gauge-invariant formalism based on projection operators, which we used to clarify the relation between the shift current and the theory of electronic polarization among other advancements for second-order non-linear optics. Here, we provide considerably more detail on the projector formalism and the geometrical invariants arising in the vicinity of a specific value of crystal momentum. We combine the introduction to multi-state quantum geometry with broadly relevant algebraic relationships and detailed example calculations, enabling extensions toward future applications to topological and geometrical properties of insulators and metals.
format Preprint
id arxiv_https___arxiv_org_abs_2412_03637
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Gauge-invariant projector calculus for quantum state geometry and applications to observables in crystals
Mitscherling, Johannes
Avdoshkin, Alexander
Moore, Joel E.
Strongly Correlated Electrons
Mesoscale and Nanoscale Physics
Materials Science
Quantum Physics
The importance of simple geometrical invariants, such as the Berry curvature and quantum metric, constructed from the Bloch states of a crystal has become well-established over four decades of research. More complex aspects of geometry emerge in properties linking multiple bands, such as optical responses. In the companion work [arXiv:2409.16358], we identified novel multi-state geometrical invariants using an explicitly gauge-invariant formalism based on projection operators, which we used to clarify the relation between the shift current and the theory of electronic polarization among other advancements for second-order non-linear optics. Here, we provide considerably more detail on the projector formalism and the geometrical invariants arising in the vicinity of a specific value of crystal momentum. We combine the introduction to multi-state quantum geometry with broadly relevant algebraic relationships and detailed example calculations, enabling extensions toward future applications to topological and geometrical properties of insulators and metals.
title Gauge-invariant projector calculus for quantum state geometry and applications to observables in crystals
topic Strongly Correlated Electrons
Mesoscale and Nanoscale Physics
Materials Science
Quantum Physics
url https://arxiv.org/abs/2412.03637