Phonon Softening and Superconductivity in Tellurium under Pressure

Francesco Mauri, Oleg Zakharov, Stefano de Gironcoli, Steven G. Louie, and Marvin L. Cohen
Phys. Rev. Lett. 77, 1151 – Published 5 August 1996
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Abstract

The phonon dispersion and the electron-phonon interaction for the β-Po and the bcc high pressure phases of tellurium are computed with density-functional perturbation theory. Our calculations reproduce and explain the experimentally observed pressure dependence of the superconducting critical temperature ( Tc) and confirm the connection between the jump in Tc and the structural phase transition. The phonon contribution to the free energy is shown to be responsible for the difference in the structural transition pressure observed in low and room temperature experiments.

  • Received 8 March 1996

DOI:https://doi.org/10.1103/PhysRevLett.77.1151

©1996 American Physical Society

Authors & Affiliations

Francesco Mauri1, Oleg Zakharov1, Stefano de Gironcoli2, Steven G. Louie1, and Marvin L. Cohen1

  • 1Department of Physics, University of California at Berkeley, and Materials Science Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720
  • 2Istituto Nazionale per la Fisica della Materia (INFM) and Scuola Internazionale Superiore di Studi Avanzati (SISSA), Via Beirut 2-4, I-34014 Trieste, Italy

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Vol. 77, Iss. 6 — 5 August 1996

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