• Structural phase transitions and piezoelectric anomalies in ordered Sc0.5Ga0.5N alloys

    • Fulltext


        Click here to view fulltext PDF

      Permanent link:

    • Keywords


      Phase transitions; piezoelectric coefficients; ordered Sc0.5Ga0.5N alloys.

    • Abstract


      Local-density approximation calculations (LDA) within density functional theory (DFT) and Berry phase approach within modern theory of polarization are performed to predict the structural and piezoelectric properties of ordered Sc0.5Ga0.5N alloys under compressive and tensile in-plane strain. This alloy is found to exhibit a tremendous piezoelectric response, associated with a phase transition from nonpolar 𝑝63/𝑚𝑐𝑐(𝐷6h) space group to a polar 𝑝63𝑚𝑐(𝐶6v) structure, at fixed Ga and Sc compositions when continuously changing the experimental accessible parameters (i.e. the compressive and tensile strain). The mechanism of the effects behind such anomalous behaviour is revealed and explained.

    • Author Affiliations


      A M Alsaad1 A A Ahmad1

      1. Department of Physical Sciences, Jordan University of Science & Technology, P.O. Box 3030, Irbid 221100, Jordan
    • Dates

  • Bulletin of Materials Science | News

    • Dr Shanti Swarup Bhatnagar for Science and Technology

      Posted on October 12, 2020

      Prof. Subi Jacob George — Jawaharlal Nehru Centre for Advanced Scientific Research, Jakkur, Bengaluru
      Chemical Sciences 2020

      Prof. Surajit Dhara — School of Physics, University of Hyderabad, Hyderabad
      Physical Sciences 2020

    • Editorial Note on Continuous Article Publication

      Posted on July 25, 2019

      Click here for Editorial Note on CAP Mode

© 2021-2022 Indian Academy of Sciences, Bengaluru.