Lateral interaction in Be and Mg layers on the Mo(112) surface

  • I. N. YakovkinEmail author
Regular Article


The formation of structures of Be and Mg on the furrowed Mo(112) surface has been studied by DFT. Both Be and Mg adsorb in furrows. The adsorption of small Be adatoms results in the smoothing of the surface and therefore increases the work function. The dominant lateral interaction for Be on Mo(112) is the attraction between nearest-neighbor Be adatoms, which, at low coverages, leads to the formation of islands of the p(1 × 1) structure. In contrast, larger Mg adatoms are polarized, so that the work function decreases. Friedel oscillations of screening electrons, enhanced due to existence of flat segments of Fermi surface, provide a favorable decay asymptotic of the indirect interaction along the furrows, which explains the formation of the p(4 × 1) chain structure in Mg layers on Mo(112).


Solid State and Materials 


  1. 1.
    V.K. Medvedev, I.N. Yakovkin, Fiz. Tverd. Tela 20, 928 (1978)Google Scholar
  2. 2.
    V.K. Medvedev, I.N. Yakovkin, Fiz. Tverd. Tela 21, 313 (1979)Google Scholar
  3. 3.
    V.K. Medvedev, I.N. Yakovkin, Fiz. Tverd. Tela 23, 669 (1981)Google Scholar
  4. 4.
    G.A. Katrich, V.V. Klimov, I.N. Yakovkin, J. Electron Spectros. Relat. Phenomena 68, 369 (1994)CrossRefGoogle Scholar
  5. 5.
    A. Fedorus, G. Godzik, V. Koval, A. Naumovets, H. Pfnür, Surf. Sci. 460, 229 (2000)ADSCrossRefGoogle Scholar
  6. 6.
    O.M. Braun, V.K. Medvedev, Sov. Phys. Usp. 32, 328 (1989)ADSCrossRefGoogle Scholar
  7. 7.
    I.N. Yakovkin, G.A. Katrich, A.T. Loburets, Yu.S. Vedula, A.G. Naumovets, Progr. Surf. Sci. 59, 355 (1998)ADSCrossRefGoogle Scholar
  8. 8.
    I.N. Yakovkin, J. Nanosci. Nanotechnol. 1, 357 (2001)CrossRefGoogle Scholar
  9. 9.
    E. Chrzanowski, E. Bauer, Surf. Sci. 173, 106 (1986)ADSCrossRefGoogle Scholar
  10. 10.
    A.G. Fedorus, A.A. Mitryaev, A.G. Naumovets, Surf. Sci. 606, 580 (2012)ADSCrossRefGoogle Scholar
  11. 11.
    I.N. Yakovkin, Surf. Sci. 605, 306 (2011)ADSCrossRefGoogle Scholar
  12. 12.
    R. Smoluchowski, Phys. Rev. 60, 661 (1941)ADSzbMATHCrossRefGoogle Scholar
  13. 13.
    T.B. Grimley, Proc. Phys. Soc. 92, 776 (1967)ADSCrossRefGoogle Scholar
  14. 14.
    K.H. Lau, W. Kohn, Surf. Sci. 75, 69 (1978)ADSCrossRefGoogle Scholar
  15. 15.
    T.L. Einstein, CRC Crit. Rev. Sol. St. Mat. Sci. 7, 261 (1978)CrossRefGoogle Scholar
  16. 16.
    A. Kiejna, R.M. Nieminen, Phys. Rev. B 69, 235424 (2004)ADSCrossRefGoogle Scholar
  17. 17.
    I.N. Yakovkin, Surf. Sci. 389, 48 (1997)ADSCrossRefGoogle Scholar
  18. 18.
    I.N. Yakovkin, J. Zhang, P.A. Dowben, Phys. Rev. B 63, 115408 (2001)ADSCrossRefGoogle Scholar
  19. 19.
    N. Wu, Ya.B. Losovyj, Zh. Yu, R.F. Sabirianov, W.N. Mei, N. Lozova, J.A. Colón Santana, P.A. Dowben, J. Phys.: Condens. Matter 21, 474222 (2009)ADSCrossRefGoogle Scholar
  20. 20.
    I.N. Yakovkin, P.A. Dowben, J. Phys.: Condens. Matter 23, 225503 (2011)ADSCrossRefGoogle Scholar
  21. 21.
    K. Fukutani, H. Hayashi, I.N. Yakovkin, T.R. Paudel, T. Habuchi, D. Hirayama, J. Jiang, H. Iwasawa, K. Shimada, Ning Wu, E.Y. Tsymbal, P.A. Dowben, Phys. Rev. B 85, 155435 (2012)ADSCrossRefGoogle Scholar
  22. 22.
    I.N. Yakovkin, K. Fukutani, H. Hayashi, J. Jiang, T. Horike, Y. Nagata, T. Habuchi, D. Hirayama, H. Iwasawa, K. Shimada, Ya.B. Losovyj, P.A. Dowben, Phys. Rev. B 86, 125401 (2012)ADSCrossRefGoogle Scholar
  23. 23.
    X. Gonze, J.-M. Beuken, R. Caracas, F. Detraux, M. Fuchs, G.-M. Rignanese, L. Sindic, M. Verstraete, G. Zerah, F. Jollet, M. Torrent, A. Roy, M. Mikami, Ph. Ghosez, J.-Y. Raty, D.C. Allan, Comput. Mater. Sci. 25, 478 (2002)CrossRefGoogle Scholar
  24. 24.
    N. Troullier, J.L. Martins, Phys. Rev. B 43, 1993 (1991)ADSCrossRefGoogle Scholar
  25. 25.
    J.P. Perdew, K. Burke, M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996)ADSCrossRefGoogle Scholar
  26. 26.
    H.J. Monkhorst, J.D. Pack, Phys. Rev. B 13, 5188 (1976)MathSciNetADSCrossRefGoogle Scholar
  27. 27.
    H.B. Schlegel, J. Comput. Chem. 3, 214 (1982)CrossRefGoogle Scholar
  28. 28.
    J. Neugebauer, M. Scheffler, Phys. Rev. B 46, 16067 (1992)ADSCrossRefGoogle Scholar
  29. 29.
    L. Bengtsson, Phys. Rev. B 59, 12301 (1999)MathSciNetADSCrossRefGoogle Scholar
  30. 30.
    A. Kiejna, Phys. Rev. B 74, 235429 (2006)ADSCrossRefGoogle Scholar
  31. 31.
    I.N. Yakovkin, Surf. Sci. 282, 195 (1993)ADSCrossRefGoogle Scholar
  32. 32.
    R. Szukiewicz, J. Kołaczkiewicz, I.N. Yakovkin, Surf. Sci. 602, 2610 (2008)ADSCrossRefGoogle Scholar

Copyright information

© EDP Sciences, SIF, Springer-Verlag Berlin Heidelberg 2012

Authors and Affiliations

  1. 1.Institute of Physics, National Academy of Sciences of UkraineKievUkraine

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