Comparative study of phonon-limited carrier transport in the nodal-line semimetal ZrSiX (X = S, Se, Te) family
Oral-In-person
Abstract
ZrSiX (X = S, Se, Te) topological square-net nodal-line semimetals offer a clean platform to probe charge transport. We present a cross-family, first-principles study of phonon-limited transport using Wannier-interpolated electron-phonon coupling within the Boltzmann transport formalism. We analyze temperature-dependent conductivity trends across the series and relate them to the underlying electronic and vibrational structures. Our zero-field results are compared with available experimental measurements, showing consistent magnitudes and trends. This provides a reproducible baseline for phonon-limited transport in the ZrSiX family.
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Presenters
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Charbel Dawra
- SUNY Binghamton University