Structural and electronic properties of carbon-doped c-BN(110) surface


KÖKTEN H. , ERKOÇ Ş.

PHYSICA B-CONDENSED MATTER, cilt.404, ss.4937-4938, 2009 (SCI İndekslerine Giren Dergi) identifier identifier

  • Cilt numarası: 404
  • Basım Tarihi: 2009
  • Doi Numarası: 10.1016/j.physb.2009.08.258
  • Dergi Adı: PHYSICA B-CONDENSED MATTER
  • Sayfa Sayıları: ss.4937-4938

Özet

The structural and electronic properties of a substitutional C atom in a neutral charge state on both the B and N site of the c-BN(110) surface have been investigated from a theoretical point of view using density functional theory. The impurity formation energies [unrelaxed (E(f)(0)) and relaxed (E(f))] are reported for the first time for the c-BN(110) surface. (C) 2009 Elsevier B.V. All rights reserved.