Fermi surface nesting and intrinsic resistivity of beryllium: First-principles calculations

Zhe Liu, Mingfeng Zhu, and Yisong Zheng
Phys. Rev. B 100, 045145 – Published 29 July 2019

Abstract

Within the semiclassical Boltzmann transport theory, we perform a systematic first-principles calculation of the intrinsic resistivity of beryllium, a nodal-line semimetal. The Wannier interpolation technique to treat the electron-phonon (e-ph) interaction is employed to guarantee a high precision of the numerical results. Our numerical results of the intrinsic resistivity of beryllium agree quantitatively with experimental data in a large temperature range. We find that around each joint region between the electron and hole pockets, the Fermi surface of beryllium forms a pair of vertical facets (parallel to c axis). Then, the nesting effect between such Fermi surface segments near inequivalent vertices of the hexagonal Brillouin zone can be realized by e-ph scattering with a relatively short phonon wavelength. Such a Fermi surface nesting effect plays the dominant role in the intrinsic resistivity. It is also the underlying mechanism for linear temperature dependence of the intrinsic resistivity from a very low critical temperature (200 K). In contrast, the contribution of the topological nontrivial states near the nodal line to the intrinsic resistivity is less important because only a few of such states appear in the vicinity of the Fermi surface due to the sizable dispersion of the nodal line.

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  • Received 13 April 2019
  • Revised 5 June 2019

DOI:https://doi.org/10.1103/PhysRevB.100.045145

©2019 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Zhe Liu, Mingfeng Zhu, and Yisong Zheng*

  • Key Laboratory of Physics and Technology for Advanced Batteries (Ministry of Education), Department of Physics, Jilin University, Changchun 130012, People's Republic of China

  • *Corresponding author: zys@jlu.edu.cn

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Issue

Vol. 100, Iss. 4 — 15 July 2019

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