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Half-Heusler topological insulators: A first-principles study with the Tran-Blaha modified Becke-Johnson density functional
Open accessAbstract
We systematically investigate the topological band structures of half-Heusler compounds using first-principles calculations. The modified Becke-Johnson exchange potential together with local-density approximation for the correlation potential (MBJLDA) has been used here to obtain accurate band inversion strength and band order. Our results show that a large number of half-Heusler compounds are candidates for three-dimensional topological insulators. The difference between band structures obtained using the LDA and MBJLDA potential is also discussed.
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Cites
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Topological electronic structure in half-Heusler topological insulators
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Ando, Y. (2013) · Journal of the Physical Society of Japan · doi:10.7566/jpsj.82.102001 · Cited by 1,789
Merits and limits of the modified Becke-Johnson exchange potential
Koller, D., Tran, F., & Blaha, P. (2011) · Physical Review B · doi:10.1103/physrevb.83.195134 · Cited by 1,079
Comprehensive search for topological materials using symmetry indicators
Tang, F., Po, H. C., Vishwanath, A., & Wan, X. (2019) · Nature · doi:10.1038/s41586-019-0937-5 · Cited by 761
Emergence of non-centrosymmetric topological insulating phase in BiTeI under pressure
Bahramy, M. S., Yang, B.-J., Arita, R., & Nagaosa, N. (2012) · Nature Communications · doi:10.1038/ncomms1679 · Cited by 262
Quadratic Fermi node in a 3D strongly correlated semimetal
Kondo, T., Nakayama, M., Chen, R., Ishikawa, J. J., Moon, E.-G., Yamamoto, T., Ota, Y., Malaeb, W., Kanai, H., Nakashima, Y., et al. (2015) · Nature Communications · doi:10.1038/ncomms10042 · Cited by 190
Metadata
- Authors
- Feng, W., Xiao, D., Zhang, Y., & Yao, Y.
- Venue
- Physical Review B
- Publisher
- American Physical Society (APS)
- Published
- 2010-12-15
- Volume
- 82
- Issue
- 23
- ISSN
- 1098-0121 (ISSN-L)
- 1550-235X
- OpenAlex
- W2049267765
- Cited by
- 200
- References
- 10
- FWCI
- 7.76
- Type
- journal article
- Language
- en
- Open access
- green
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