Electron-phonon coupling and hot electron thermalization in titanium nitride

Stefano Dal Forno and Johannes Lischner
Phys. Rev. Materials 3, 115203 – Published 21 November 2019
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Abstract

We have studied the thermalization of hot carriers in both pristine and defective titanium nitride (TiN) using a two-temperature model. All parameters of this model, including the electron-phonon coupling parameter, were obtained from first-principles density-functional theory calculations. The virtual-crystal approximation was used to describe defective systems. We find that thermalization of hot carriers occurs on much faster timescales than in gold as a consequence of the significantly stronger electron-phonon coupling in TiN. Specifically, the largest thermalization times, on the order of 200 femtoseconds, are found in TiN with nitrogen vacancies for electron temperatures around 4000 K.

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  • Received 7 August 2019
  • Revised 21 October 2019

DOI:https://doi.org/10.1103/PhysRevMaterials.3.115203

©2019 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Stefano Dal Forno1,* and Johannes Lischner2,†

  • 1Department of Physics, Imperial College London, London SW7 2AZ, United Kingdom
  • 2Department of Physics, Department of Materials, and the Thomas Young Centre for Theory and Simulation of Materials, Imperial College London, London SW7 2AZ, United Kingdom

  • *tenobaldi@gmail.com
  • j.lischner@imperial.ac.uk

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Issue

Vol. 3, Iss. 11 — November 2019

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