Skip to main content

Electronic Structure and Properties of Layered Structures

  • Chapter
  • First Online:
Surface Properties of Layered Structures

Part of the book series: Physics and Chemistry of Materials with Low-Dimensional Structures ((PCMALS,volume 16))

Abstract

The electronic structure of layered materials — both natural and artificial — is a subject of growing interest and investigation. This growing interest in the experimental aspects of these studies is clearly given in the other chapters of this book. Here we present some illustrations of the theoretical work on layered semiconductor structures. Because of space limitations, no attempt at completeness can be attempted; thus we confine ourselves to three examples taken from our own work.

This is a preview of subscription content, log in via an institution to check access.

Access this chapter

Chapter
USD 29.95
Price excludes VAT (USA)
  • Available as PDF
  • Read on any device
  • Instant download
  • Own it forever
eBook
USD 169.00
Price excludes VAT (USA)
  • Available as PDF
  • Read on any device
  • Instant download
  • Own it forever
Softcover Book
USD 219.99
Price excludes VAT (USA)
  • Compact, lightweight edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info
Hardcover Book
USD 219.99
Price excludes VAT (USA)
  • Durable hardcover edition
  • Dispatched in 3 to 5 business days
  • Free shipping worldwide - see info

Tax calculation will be finalised at checkout

Purchases are for personal use only

Institutional subscriptions

Preview

Unable to display preview. Download preview PDF.

Unable to display preview. Download preview PDF.

References

  1. H. J. F. Jansen and A. J. Freeman, Phys. Rev. B 30, 561 (1984).

    Article  ADS  Google Scholar 

  2. L. Hedin and B. I. Lundqvist, J. Phys. C 4, 2064 (1971).

    Article  ADS  Google Scholar 

  3. U. Von Barth and L. Hedin, J. Phys. C 5, 1629 (1972).

    Article  ADS  Google Scholar 

  4. W. Kohn and L. J Sham, Phys. Rev. 140, A1133 (1965); L. J. Sham and W. Kohn, Phys. Rev. 145, 561 (1966).

    Google Scholar 

  5. J. C. Slater, Phys. Rev 51, 846 (1937).

    Article  ADS  Google Scholar 

  6. M. Weinert, J. Math. Phys. 22, 2433 (1981).

    Article  MathSciNet  ADS  Google Scholar 

  7. P. Pfluger and H.J. Güntherodt, Festkörperproblenae: Advances in Solid State Physics, edited by J. Treusch (Vieweg, Braunschweig, 1981), Vol. 21, p. 271 and references therein.

    Google Scholar 

  8. H. Kamimura, Ann. Phys. (France) 11, 39 (1986).

    Google Scholar 

  9. T. Takahashi, N. Gunasekara, T. Sagawa and H. Suematsu, J. Phys. Soc. Jpn 55, 3498 (1986).

    Article  ADS  Google Scholar 

  10. M. Posternak, A. Baldereschi, A.J. Freeman, E. Wimmer and M. Weinert, Phys. Rev. Lett. 50, 761 (1983); Mat. Res. Soc. Symp. Proc. 20, 117 (1983).

    Google Scholar 

  11. E. Wimmer, H. Krakauer, M. Weinert and A.J. Freeman, Phys. Rev. B24, 864 (1981).

    ADS  Google Scholar 

  12. N.A.W. Holzwarth, S. Rabii and L.A. Girifalco, Phys. Rev. B18, 5190 (1978).

    ADS  Google Scholar 

  13. The three systems studied in this section have D6h symmetry. The irreducible repre­sentations of this group are labeled according to the notations of G.F. Koster, J.O. Dimmock, R.G. Wheeler and H. Statz, Properties of the thirty-two point groups, M.I.T. Press, Cambridge, (1963).

    Google Scholar 

  14. According to Ref. 12, the bottom of the Li band in LiC6 is 1.7 eV above EF. Notice however that, assuming rigid bands, we calculate that E F (LiC6) EF (C 6 —Li­C6) + 0.4 eV since the concentration of Li atoms in LiC6 is twice that in C6—Li—C6.

    Google Scholar 

  15. Observation of K 4s states in KC8 at about this energy has been reported e.g. by J.J. Ritsko and C.F. Brucker, Solid State Commun. 44, 889 (1982).

    Google Scholar 

  16. L. Samuelson and I.P. Batra, J. Phys. C13, 5105 (1980), and reference therein.

    Google Scholar 

  17. W. van Haeringen and H.G. Junginger, Solid State Commun. 7, 1723 (1969).

    Article  ADS  Google Scholar 

  18. C.P. Mallett, J. Phys. C14, L213 (1981).

    ADS  Google Scholar 

  19. Th. Fauster, F.J. Himpsel, J.E. Fischer and E.W. Plummer, Phys. Rev. Lett. 51, 430 (1983).

    Article  ADS  Google Scholar 

  20. F. Maeda, T. Takahashi, H. Ohsawa and S. Suzuki, Phys. Rev. 837, 4482 (1988).

    Google Scholar 

  21. T. Takahashi, H. Tokailin and T. Sagawa, Phys. Rev. B32, 8317 (1985).

    ADS  Google Scholar 

  22. N.A.W. Holzwarth, S.G. Louie and S. Rabii, Phys. Rev. B26, 5382 (1982).

    ADS  Google Scholar 

  23. M. Posternak, A. Baldereschi, A.J. Freeman and E. Wimmer, Phys. Rev. Lett. 52, 863 (1984).

    Article  ADS  Google Scholar 

  24. G.B. Bachelet, D.R. Hamann and M. Schlüter, Phys. Rev. B26, 4199 (1982).

    ADS  Google Scholar 

  25. A. Catellani, M. Posternak, A. Baldereschi, H.J.F. Jansen and A.J. Freeman, Phys. Rev.B 32, 6997 (1985).

    Article  ADS  Google Scholar 

  26. R.W.G. Wyckoff, Crystal Structures (Interscience, New York, 1965), Vol. 1.

    Google Scholar 

  27. P. Villars and L.D. Calvert, Pearson’s Handbook of Crystallographic Data for Inter-metallic Phases (American Society for Metals, Metals Park, 1985), Vol. 2.

    Google Scholar 

  28. J. Robertson, Phys. Rev. B29, 2131 (1984).

    ADS  Google Scholar 

  29. A. Catellani, M. Posternak and A. Baldereschi, Phys. Rev. B36, 6105 (1987).

    ADS  Google Scholar 

  30. W.P. Pearson, A Handbook of Lattice Spacing and Structures of Metals, Vol. 2, (Perg­amon Press, Oxford, 1967), p. 35.

    Google Scholar 

  31. B. Post, Boron, Metallo-Boron Compounds and Boranes,edited by R.M. Adams (Wi­ley, New York, 1964).

    Google Scholar 

  32. F. Hulliger and E. Mooser, Prog. Solid State Chem. 2, 330 (1965).

    Article  Google Scholar 

  33. H.J. Juretschke and R. Steinitz, J. Phys. Chem. Solids 4, 118 (1958).

    Article  ADS  Google Scholar 

  34. P. Pfuger and H.J. Guntherodt, Festkörperprobleme XXI, ed. J. Treusch (Vieweg, Braunschweig, 1981), p. 271.

    Google Scholar 

  35. D.M. Adams, Inorganic Solids (John Wiley, New York, 74) p. 223.

    Google Scholar 

  36. H. Ihara, M. Hirabayashi, and H. Nakagawa, Phys. Rev. B16, 726 (1977).

    ADS  Google Scholar 

  37. T. Tanaka, Y. Ishizawa, E. Bannai, and S. Kawai, Sol. State Commun 26, 879 (1978).

    Article  ADS  Google Scholar 

  38. R.C. Linton, Thin Solid Film 20, 17 (1974).

    Article  ADS  Google Scholar 

  39. D.W. Fisher and W.L. Baun, J. Appl. Phys. 39, 4757 (1968).

    Article  ADS  Google Scholar 

  40. L. Ramqvist, B. Ekstig, E. Köline, E. Noreland, and R. Manne, J Phys. Chem. Solids 30, 1849 (1969).

    Article  ADS  Google Scholar 

  41. I.I. Lyakovskaya, T.M. Zimkina and V.A. Formichev, Soviet Phys.: Solid State 12, 138 (1970).

    Google Scholar 

  42. I.I. Tupitsyn, I.I. Lyakovskaya, M.S. Nakhmanson, and A.S. Sukhikh, Soy. Phys.: Solid State 16, 2015 (1975).

    Google Scholar 

  43. Y.S. Tyan, L.E. Toth and Y.A. Chang, J. Phys. Chem. Solids 30, 785 (1969).

    Article  ADS  Google Scholar 

  44. J. Castaing, R. Caudraun, G. Toupance, P. Costa, Solid State Commun. 7, 1453 (1969).

    Article  ADS  Google Scholar 

  45. E. Dempsey, Philos. Mag. 8, 285, (1963).

    Article  ADS  Google Scholar 

  46. A.H. Silver and P.J. Bray, J. Chem Phys. 32, 288 (1960).

    Article  ADS  Google Scholar 

  47. I.I. Tupitsyn, Sov. Phys. Solid State 18, 1688 (1976).

    Google Scholar 

  48. D.R. Armstrong, A. Breeze, and P.G. Perkins, J. Chem. Soc. Faraday Trans I,I 73, 952 (1977).

    Google Scholar 

  49. S.H. Liu, L. Kopp, W.B. England, and H.W. Myron, Phys. Rev. B11, 3463 (1975).

    ADS  Google Scholar 

  50. D.L. Johnson, B.N. Harmon and S.H. Liu, J. Chem. Phys. 73, 1898 (1980) and refer­ences therein.

    Google Scholar 

  51. D.R. Armstrong, Theoret. Chim. Acta 64, 137 (1983).

    Article  Google Scholar 

  52. S. Massidda and A. Baldereschi, Solid State Commun. 66, 855 (1988).

    Article  ADS  Google Scholar 

  53. S. Massidda, Ph.D. Thesis, ISAS Trieste (Italy) 1985, unpublished.

    Google Scholar 

  54. C. Froese Fisher, Atomic Data and Nuclear Data 4, 301 (1972).

    Article  ADS  Google Scholar 

  55. S. Massidda, B.I. Min and A.J. Freeman, Phys. Rev. B35, 9871 (1987).

    ADS  Google Scholar 

  56. S.H. Wei and A. Zunger, Phys. Rev. Lett. 59, 144 (1987).

    Article  ADS  Google Scholar 

  57. A. Continenza, S. Massidda and A.J. Freeman, J. Magn. Magn. Mat. 78, 195 (1989).

    Article  ADS  Google Scholar 

  58. A. Continenza, S. Massidda and A.J. Freeman Phys. Rev. B42, 2904 (1990).

    Google Scholar 

  59. G.A. Prinz, B.T. Jonker, J.J. Krebs, J.M. Ferrari and F. Kovanic. Appl. Phys. Lett. 48, 1756 (1986).

    Article  ADS  Google Scholar 

  60. G.A. Prinz and J. Krebs, Appl. Phys. Lett. 39, 397 (1981).

    Article  ADS  Google Scholar 

  61. G.A. Prinz, Phys. Rev. Lett. 54, 1051 (1985).

    Article  Google Scholar 

  62. G.A. Prinz, B.T. Jonker and J.J. Krebs, Bull. of Am. Phys. Soc. 33, 562 (1988).

    Google Scholar 

  63. B.T. Jonker, K.H. Walker, E. Kisker, G.A. Prinz, and C. Carbone, Phys. Rev. Lett. 57, 142 (1986).

    Article  ADS  Google Scholar 

  64. J.J. Krebs, B.T. Jonker and G.A. Prinz, J. Appl. Phys. 61, 374 (1987).

    Google Scholar 

  65. S. Ohnishi, A.J. Freeman and M. Weinert, Phys. Rev. B28, 6741 (1983).

    ADS  Google Scholar 

  66. A.J. Freeman and R. E. Watson in Magnetism, Vol. IIA, edited by G. T. Rado and H. Suhl (Academic Press, New York 1966).

    Google Scholar 

  67. L. Pauling in The Chemical Bond (Cornell Univ. Press, New York, 1967).

    Google Scholar 

  68. A.R. Miedema, F.R. de Boer and P.F. de Chatel, J. Phys. F3, 1558 (1973).

    Article  ADS  Google Scholar 

  69. C.A. Mead, Solid State Electr. 9, 1023 (1966); C.A. Mead, Phys. Lett. 18, 218 (1966).

    Google Scholar 

  70. F. Xu, M. Vos, J.H. Weaver and H. Cheng, Phys. Rev. B38, 13418 (1988).

    ADS  Google Scholar 

  71. S.G. Anderson, F. Xu, M. Vos, J. H. Weaver and H. Cheng Phys. Rev. B39, 5079 (1989).

    ADS  Google Scholar 

  72. G.P. Das, P. Blochl, O.K. Andersen, N.E. Christensen and O. Gunnarsson, Phys. Rev. Lett. 63, 1168 (1989).

    Article  ADS  Google Scholar 

  73. A. Continenza, S. Massidda and A.J. Freeman, Phys. Rev B41, 12013 (1990).

    ADS  Google Scholar 

  74. A. Continenza, S. Massidda and A. J. Freeman, Phys. Rev. B42, 3469 (1990).

    ADS  Google Scholar 

  75. C.G. Van de Walle and R. Martin, Phys. Rev. B37, 4801 (1988) and references therein.

    Article  ADS  Google Scholar 

  76. W.R.L. Lambrecht and B. Segall, Phys. Rev. B41, 2832 (1990).

    ADS  Google Scholar 

  77. A. Baldereschi, S. Baroni, and R. Resta, Phys. Rev. Lett. 61, 734 (1988).

    Article  ADS  Google Scholar 

  78. R.P. Schneider Jr. and B.W. Wessels, Appl. Phys. Lett. 54, 1142 (1989).

    Article  ADS  Google Scholar 

  79. K. Huang and B.W. Wessels, J. Appl. Phys. 64, 6770 (1988).

    Article  ADS  Google Scholar 

  80. D.V. Lang, M.B. Panish, F. Capasso, J. Allarn, R.A. Hamm, A.M. Sergent and W.T. Tsang, J. Vac. Sci. Technol. B5, 1215 (1987).

    Google Scholar 

  81. J.R. Waldrop, R.W. Grant and E.A. Kraut, Appl. Phys. Lett. 54, 1878 (1989).

    Article  ADS  Google Scholar 

  82. S. Massidda, A. Continenza, A.J. Freeman, T.M. De Pascale, F. Meloni and M. Serra, Phys. Rev B41, 12079 (1990).

    ADS  Google Scholar 

Download references

Author information

Authors and Affiliations

Authors

Editor information

Editors and Affiliations

Rights and permissions

Reprints and permissions

Copyright information

© 1992 Springer Science+Business Media Dordrecht

About this chapter

Cite this chapter

Freeman, A.J., Continenza, A., Posternak, M., Massidda, S. (1992). Electronic Structure and Properties of Layered Structures. In: Benedek, G. (eds) Surface Properties of Layered Structures. Physics and Chemistry of Materials with Low-Dimensional Structures, vol 16. Springer, Dordrecht. https://doi.org/10.1007/978-94-011-2684-7_3

Download citation

  • DOI: https://doi.org/10.1007/978-94-011-2684-7_3

  • Published:

  • Publisher Name: Springer, Dordrecht

  • Print ISBN: 978-94-010-5188-0

  • Online ISBN: 978-94-011-2684-7

  • eBook Packages: Springer Book Archive

Publish with us

Policies and ethics