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Three dimensional topological insulators of LuPdBixSb1−x alloys
- Source :
- Journal of Alloys and Compounds. 549:51-56
- Publication Year :
- 2013
- Publisher :
- Elsevier BV, 2013.
-
Abstract
- The topological band structures of LuPdBi x Sb 1− x (for x = 0, 0.125, 0.25, 0.375, 0.5, 0.625, 0.75, 0.875, 1) alloys have been investigated using density functional theory by Wien2k package. The generalized gradient approximation (GGA) and Engel–Vosko generalized gradient approximation (GGA_EV) have been used to obtain accurate the band inversion strength and band order. The calculated results show that LuPdBi x Sb 1− x alloys for x ⩾ 0.25 in GGA and x ⩾ 0.375 in GGA_EV are candidates for three dimensional topological insulator or topological metal. Furthermore the effect of hydrostatic pressure on band inversion strength and band order of these alloys has been investigated.
Details
- ISSN :
- 09258388
- Volume :
- 549
- Database :
- OpenAIRE
- Journal :
- Journal of Alloys and Compounds
- Accession number :
- edsair.doi...........ed9704a4a0510fdbd4cbe83f9ad90cf6