2013
DOI: 10.1103/physrevb.87.115106
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Spin-polarized (001) surface states of the topological crystalline insulator Pb0.73Sn0.27Se

Abstract: We study the nature of (001) surface states in Pb0.73Sn0.27Se in the newly discovered topologicalcrystalline-insulator (TCI) phase as well as the corresponding topologically trivial state above the band-gap-inversion temperature. Our calculations predict not only metallic surface states with a nontrivial chiral spin structure for the TCI case, but also nonmetallic (gapped) surface states with nonzero spin polarization when the system is a normal insulator. For both phases, angle-and spinresolved photoelectron … Show more

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Cited by 76 publications
(90 citation statements)
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“…We have used the virtual crystal approximation for the solid solu- tion of PbSe and SnSe, both in rock-salt structure, using temperature-dependent tight binding parameters described previously 6 . We note that the band structure of rock-salt SnSe has not been verified experimentally, and hence the parameterization of this material is based solely on the results of density functional theory calculations.…”
Section: Band Structure Calculationsmentioning
confidence: 99%
“…We have used the virtual crystal approximation for the solid solu- tion of PbSe and SnSe, both in rock-salt structure, using temperature-dependent tight binding parameters described previously 6 . We note that the band structure of rock-salt SnSe has not been verified experimentally, and hence the parameterization of this material is based solely on the results of density functional theory calculations.…”
Section: Band Structure Calculationsmentioning
confidence: 99%
“…The Dirac points on (111) surface are robust against translational symmetry breaking [17]. So far most of the experiments [15,16,[18][19][20][21][22][23] [24]. The experiments were performed in an ultrahigh vacuum system that consists of a MBE growth chamber, a low temperature scanning tunneling microscope (STM) (omicron) and an angle-resolved photoemission spectrometer (VG-scienta) with a base pressure better than 1×10 −10 mbar.…”
mentioning
confidence: 99%
“…9,10,12,17,21,55 After accounting for differences in composition and temperature, the dispersion of the Dirac-like states is quite consistent. Scanning tunneling microscopy observations show that these cleaved surfaces consist of atomically flat terraces separated by 50-100 nm.…”
Section: The Role Of Atomic Terracesmentioning
confidence: 80%
“…54 We assume that the temperature dependence is dominated by the change of the lattice constant a 0 , and rescale our parameterization according to the Harrison rules. 55 Similarly, biaxial strain is treated by rescaling hopping parameters such that the change in energy gap with strain is in agreement with the experimentally determined deformation potential 56 and elastic constants. 57 The spectral densities projected on specific atomic layers have been calculated with the use of a tight-binding Hamiltonian for a semi-infinite system and an appropriate modification of a recursive Green's function method described by Lopez Sancho.…”
Section: Heterostructure Fabricationmentioning
confidence: 99%