Back to Search
Start Over
Importance of interactions for the band structure of the topological Dirac semimetal Na3Bi
- Publication Year :
- 2020
-
Abstract
- We experimentally measure the band dispersions of topological Dirac semimetal ${\mathrm{Na}}_{3}\mathrm{Bi}$ using Fourier-transform scanning tunneling spectroscopy to image quasiparticle interference on the (001) surface of molecular-beam epitaxy-grown ${\mathrm{Na}}_{3}\mathrm{Bi}$ thin films. We find that the velocities for the lowest-lying conduction and valence bands are $1.6\ifmmode\times\else\texttimes\fi{}{10}^{6}\phantom{\rule{4pt}{0ex}}\mathrm{m}{\mathrm{s}}^{\ensuremath{-}1}$ and $4.2\ifmmode\times\else\texttimes\fi{}{10}^{5}\phantom{\rule{4pt}{0ex}}\mathrm{m}{\mathrm{s}}^{\ensuremath{-}1}$ respectively, significantly higher than previous theoretical predictions. We compare the experimental band dispersions to the theoretical band structures calculated using an increasing hierarchy of approximations of self-energy corrections due to interactions: generalized gradient approximation (GGA), meta-GGA, Heyd-Scuseria-Ernzerhof exchange-correlation functional (HSE06), and $GW$ methods. We find that density functional theory methods generally underestimate the electron velocities. However, we find significantly improved agreement with an increasingly sophisticated description of the exchange and interaction potential, culminating in reasonable agreement with experiments obtained by the $GW$ method. The results indicate that exchange-correlation effects are important in determining the electronic structure of this ${\mathrm{Na}}_{3}\mathrm{Bi}$, and are likely the origin of the high velocity. The electron velocity is consistent with recent experiments on ultrathin ${\mathrm{Na}}_{3}\mathrm{Bi}$ and also may explain the ultrahigh carrier mobility observed in heavily electron-doped ${\mathrm{Na}}_{3}\mathrm{Bi}$.
- Subjects :
- Physics
Condensed Matter - Materials Science
Valence (chemistry)
Strongly Correlated Electrons (cond-mat.str-el)
Scanning tunneling spectroscopy
Materials Science (cond-mat.mtrl-sci)
FOS: Physical sciences
02 engineering and technology
Electronic structure
Electron
021001 nanoscience & nanotechnology
Topology
01 natural sciences
Semimetal
Condensed Matter - Other Condensed Matter
Condensed Matter - Strongly Correlated Electrons
0103 physical sciences
Quasiparticle
Density functional theory
010306 general physics
0210 nano-technology
Electronic band structure
Other Condensed Matter (cond-mat.other)
Subjects
Details
- Language :
- English
- Database :
- OpenAIRE
- Accession number :
- edsair.doi.dedup.....645167c1c6ea84b8087b94ca9066cd97