Effect of dimensionality on charge density wave instabilities in TaS$_2$ and TaSe$_2$

ORAL

Abstract

Recent successes in making exfoliated single-layer transition-metal dichalcogenides has brought new interest to these materials, particularly with respect to the effects of dimensionality. As layered bulk materials, the 1T and 2H polymorphs of TaS$_2$ and TaSe$_2$ undergo a number of charge-density-wave (CDW) transitions. However, recent experiments have found that the CDW instability does not survive in nanopatches of 2H-TaS$_2$. Here we present a density-functional theory investigation of the CDW instability in single- and few-layer TaS$_2$ and TaSe$_2$, focusing on the role of the interlayer interactions. The effects of dimensionality on structure, electronic structure, and electronic-phonon coupling will be discussed.

Authors

  • Yizhi Ge

    Physics Department, Georgetown University

  • Amy Liu

    Georgetown University, Physics Department, Georgetown University