Topologically protected quantum metallic bonding of alkali metals: From entangled electron–phonon dynamics

We show that metallic bonding in the alkali metals can be recast as a symmetry- and topology-guided electron–phonon problem. Using mode-resolved second derivatives of band energies with respect to normal-mode displacements, we find sharp, equal-and-opposite curvature poles confined to the H → N line of the body-centered cubic Brillouin zone. These poles diagnose interband mixing within a quasi-degenerate doublet and are quantitatively captured by a minimal Dirac/two-level model with a phonon-tunable mass. Independent topology diagnostics reveal odd-parity windings and unit-chirality Weyl charges near H → N, establishing that the symmetry-selected crossings carry quantized Berry curvature. Quantizing the normal-mode coordinate elevates the static picture to a pseudo-spin-boson Hamiltonian; across the series, Li, K, Rb, and Cs lie near the resonance between degeneracy-lifting energies and longitudinal phonon frequencies, while Na is off-resonant, explaining its weaker, parabolic response. The resulting view is that “simple” metallic bonding emerges from selective, longitudinal-mode electron–phonon entanglement localized at symmetry points: phonons open and tune gaps without destroying the underlying linear dispersion. These findings suggest that quantum coherence is not merely preserved in low-dimensional systems or isolated defects but may be intrinsic to certain metallic phases. The results open new avenues for realizing lattice-based quantum sensors, analog quantum simulators, and coherence-driven materials design, embedding quantum functionality directly into the structural foundation of matter.

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Publication Details

Journal
APL Quantum
Published
2025-12-01
DOI
https://doi.org/10.1063/5.0282941
Primary Topic
Topological Materials and Phenomena
Type
article
Field-Weighted Citation Impact
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article

Topologically protected quantum metallic bonding of alkali metals: From entangled electron–phonon dynamics

Jiří Hostaš, Hsu Kiang Ooi, Junan Lin, Mohammad Sajjad Ghaemi et al.
APL Quantum
Topological Materials and Phenomena
article

Topologically protected quantum metallic bonding of alkali metals: From entangled electron–phonon dynamics

Jiří Hostaš, Hsu Kiang Ooi, Junan Lin, Mohammad Sajjad Ghaemi, H. Hu, Anguang Hu
article en

Abstract

We show that metallic bonding in the alkali metals can be recast as a symmetry- and topology-guided electron–phonon problem. Using mode-resolved second derivatives of band energies with respect to normal-mode displacements, we find sharp, equal-and-opposite curvature poles confined to the H → N line of the body-centered cubic Brillouin zone. These poles diagnose interband mixing within a quasi-degenerate doublet and are quantitatively captured by a minimal Dirac/two-level model with a phonon-tunable mass. Independent topology diagnostics reveal odd-parity windings and unit-chirality Weyl charges near H → N, establishing that the symmetry-selected crossings carry quantized Berry curvature. Quantizing the normal-mode coordinate elevates the static picture to a pseudo-spin-boson Hamiltonian; across the series, Li, K, Rb, and Cs lie near the resonance between degeneracy-lifting energies and longitudinal phonon frequencies, while Na is off-resonant, explaining its weaker, parabolic response. The resulting view is that “simple” metallic bonding emerges from selective, longitudinal-mode electron–phonon entanglement localized at symmetry points: phonons open and tune gaps without destroying the underlying linear dispersion. These findings suggest that quantum coherence is not merely preserved in low-dimensional systems or isolated defects but may be intrinsic to certain metallic phases. The results open new avenues for realizing lattice-based quantum sensors, analog quantum simulators, and coherence-driven materials design, embedding quantum functionality directly into the structural foundation of matter.

APL QuantumVol. 2(4)
Natural Sciences and Engineering Research Council of Canada (CA), Defence Research and Development Canada (CA), National Research Council Canada (CA)
Openalex Percentile: Top 70%
Topological Materials and Phenomena
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