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Volumn 11, Issue 5, 2011, Pages 2088-2091

Helical states of topological insulator Bi2Se3

Author keywords

helical states; NEGF DFT; SOI; Topological insulator

Indexed keywords

3-FOLD SYMMETRY; BRILLOUIN ZONES; DIRAC POINT; ELECTRON SPINS; EXPERIMENTAL DATA; HELICAL STATE; HELICAL SURFACES; MATERIAL BULK; NEGF-DFT; QUANTUM TRANSPORT PROPERTIES; SOI; TILT ANGLE; TOPOLOGICAL INSULATOR; TWO-DIMENSIONAL PLANES;

EID: 79955912340     PISSN: 15306984     EISSN: 15306992     Source Type: Journal    
DOI: 10.1021/nl200584f     Document Type: Article
Times cited : (57)

References (34)
  • 23
    • 79955884790 scopus 로고    scopus 로고
    • max has been chosen as 8.0 and the angular expansion is made up by 10 spheric harmonic functions in the muffin tins.
    • max has been chosen as 8.0 and the angular expansion is made up by 10 spheric harmonic functions in the muffin tins.
  • 26
    • 0004033098 scopus 로고
    • 2nd ed.; Interscience Publishers: New York.
    • Wyckoff, R. W. G. Crystal Structures, 2nd ed.; Interscience Publishers: New York, 1964.
    • (1964) Crystal Structures
    • Wyckoff, R.W.G.1
  • 27
    • 79955922941 scopus 로고    scopus 로고
    • For more details of the NEGF-DFT method used in the nanodcal tranpsort package, see ref 20; see also. In this work, we focus on equilibrium tranpsort property at zero external bias; hence NEGF is reduced to the usual equilibrium Green's functions.
    • For more details of the NEGF-DFT method used in the nanodcal tranpsort package, see ref 20; see also http://www.nanoacademic.ca. In this work, we focus on equilibrium tranpsort property at zero external bias; hence NEGF is reduced to the usual equilibrium Green's functions.
  • 32
    • 0000461628 scopus 로고
    • 3, nanodcal (20, 22) gives a band gap 0.19 eV which is close to the 0.22 eV obtained by WIEN2k. These LSDA bulk values are smaller than the experimental gap of 0.35 eV; see Table 3 in:;;;,. From Figure 1 b, the 6 QL slab has a ''bulk band gap'' of 0.26 eV. We have also calculated 3QL and 2QL; their ''bulk gaps'' are 0.44 and 1.2 eV, respectively. The gaps thus shrink toward the bulk value as the slab becomes thicker
    • 3, nanodcal (20, 22) gives a band gap 0.19 eV which is close to the 0.22 eV obtained by WIEN2k. These LSDA bulk values are smaller than the experimental gap of 0.35 eV; see Table 3 in: Black, J.; Conwell, E.M.; Seigle, L.; Spencer, C.W. J. Phys. Chem. Solids 1957, 2, 240. From Figure 1 b, the 6 QL slab has a ''bulk band gap'' of 0.26 eV. We have also calculated 3QL and 2QL; their ''bulk gaps'' are 0.44 and 1.2 eV, respectively. The gaps thus shrink toward the bulk value as the slab becomes thicker
    • (1957) J. Phys. Chem. Solids , vol.2 , pp. 240
    • Black, J.1    Conwell, E.M.2    Seigle, L.3    Spencer, C.W.4
  • 34
    • 79955884539 scopus 로고    scopus 로고
    • z of the slab is still identically zero. The nonvanishing average Φ on the two surfaces is an indication that even at the thickness of six QLs, there is still a very weak but nonzero interaction between the two surfaces across the slab. Investigating even thicker slabs by DFT requires prohibitively large computer resources beyond our ability.
    • z of the slab is still identically zero. The nonvanishing average Φ on the two surfaces is an indication that even at the thickness of six QLs, there is still a very weak but nonzero interaction between the two surfaces across the slab. Investigating even thicker slabs by DFT requires prohibitively large computer resources beyond our ability.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.