Quasiparticle Energies and Excitonic Effects of Chromium Trichloride: from Two Dimensions to Bulk

18 Jun 2020 Zhu Linghan Yang Li

Layered van der Waals (vdW) magnetic materials have attracted significant research interest to date. In this work, we employ the first-principles many-body perturbation theory to calculate excited-state properties of a prototype vdW magnet, chromium trichloride (CrCl3), covering monolayer, bilayer, and bulk structures... (read more)

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Categories


  • MATERIALS SCIENCE
  • MESOSCALE AND NANOSCALE PHYSICS
  • COMPUTATIONAL PHYSICS