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Unraveling the unusually high electrical conductivity of the delafossite metal PdCoO$_2$

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arxiv 2308.04327 v1 pith:XO3VA5OM submitted 2023-08-08 cond-mat.mtrl-sci

classification cond-mat.mtrl-sci
keywords pdcoocouplingelectron-phononfermihightransportconductivitydelafossite
verification ladder T0 review T1 audit T2 compute T3 formal
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abstract

The prototypical delafossite metal PdCoO$_2$ has been the subject of intense interest for hosting exotic transport properties. Using first-principles transport calculations and theoretical modeling, we reveal that the high electrical conductivity of PdCoO$_2$ at room temperature originates from the contributions of both high Fermi velocities, enabled by Pd $4d_{z^2}-5s$ hybridization, and exceptionally weak electron-phonon coupling, which leads to a coupling strength ($\lambda=0.057$) that is nearly an order of magnitude smaller than those of common metals. The abnormally weak electron-phonon coupling in PdCoO$_2$ results from a low electronic density of states at the Fermi level, as well as the large and strongly facetted Fermi surface with suppressed Umklapp electron-phonon matrix elements. We anticipate that our work will inform the design of unconventional metals with superior transport properties.

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