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Crystals
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https://dx.doi.org/10.48550/ar...
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Electric Transport of Nodal Line Semimetals in Single-Component Molecular Conductors

Authors: Yoshikazu Suzumura; Reizo Kato; Masao Ogata;

Electric Transport of Nodal Line Semimetals in Single-Component Molecular Conductors

Abstract

We examine an effect of acoustic phonon scattering on the electric conductivity of a single-component molecular conductor [Pd(dddt)2] (dddt = 5,6-dihydro-1,4-dithiin-2,3-dithiolate) with a half-filled band by applying the previous calculation in a two-dimensional model with Dirac cone [Phys. Rev. B. 98, 161205 (2018)], wherethe electric transport by the impurity scattering exhibits a noticeable interplay of the Dirac cone and the phonon scattering, resulting in maximum of the conductivity with increasing temperature. The conductor shows a nodal line semimetal, where the band crossing of HOMO (Highest Occupied Molecular Orbital) and LUMO (Lowest Unoccupied Molecular Orbital) provides a loop of Dirac points located close to the Fermi energy followed by the density of states (DOS) similar to that of a two-dimensional Dirac cone. Using a tight-binding (TB) model [arXiv:2008.09277], which was obtained using the crystal structure observed from a recent X ray diffraction experiment under pressure, it is shown that the obtained conductivity explains reasonably the anomalous behavior in [Pd(dddt)2] exhibiting temperature-independent resistivity at finite temperatures. This paper demonstrates a crucial role of the acoustic phonon scattering at finite temperatures in the electric conductivity of Dirac electrons. The present theoretical results of conductivity are compared with those of the experiments.

Keywords

Condensed Matter - Materials Science, Crystallography, Condensed Matter - Mesoscale and Nanoscale Physics, Materials Science (cond-mat.mtrl-sci), FOS: Physical sciences, nodal line semimetal, QD901-999, Mesoscale and Nanoscale Physics (cond-mat.mes-hall), conductivity, DOS, tight-binding model, single-component molecular conductor

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
7
Top 10%
Average
Top 10%
Green
gold