Predicting the strain-mediated topological phase transition in 3D cubic ThTaN3

The cubic ThTaN3 compound has long been known as a semiconductor with a band gap of approximately 1 eV, but its electronic properties remain largely unexplored. By using density functional theory, we find that the band gap of ThTaN3 is very sensitive to the hydrostatic pressure/strain. A Dirac cone...

Täydet tiedot

Bibliografiset tiedot
Päätekijät: Chunmei Zhang, Aijun Du
Aineistotyyppi: Artikkeli
Kieli:English
Julkaistu: Beilstein-Institut 2018-05-01
Sarja:Beilstein Journal of Nanotechnology
Aiheet:
Linkit:https://doi.org/10.3762/bjnano.9.132