Vibrational properties of the quasi-one-dimensional In/Si(111)-(4 X 1) system -: art. no. 193406

被引：11

作者：

Bechstedt, F ^{[1
]}

Krivosheeva, A ^{[1
]}

Furthmüller, J ^{[1
]}

Stekolnikov, AA ^{[1
]}

机构：

[1] Univ Jena, Inst Festkorpertheorie & Theoret Opt, D-07743 Jena, Germany

来源：

PHYSICAL REVIEW B | 2003年 / 68卷 / 19期

关键词：

D O I：

10.1103/PhysRevB.68.193406

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

We present results of ab initio studies of the In/Si(111) surface. Our findings for the equilibrium structure confirm the double zigzag chain model in very good agreement with other calculations and measurements. The harmonic analysis of the lattice vibrations indicates strong surface modes, the spectrum of which shows features similar to that observed in a recent Raman study. The In-related modes possess low frequencies and, hence, should remain occupied also at temperatures of the phase transition.

引用

页数：4

共 28 条

[1] SURFACE ELECTRONIC-STRUCTURE OF A SINGLE-DOMAIN SI(111)4X1-IN SURFACE - A SYNCHROTRON-RADIATION PHOTOEMISSION-STUDY [J].

ABUKAWA, T ;

SASAKI, M ;

HISAMATSU, F ;

GOTO, T ;

KINOSHITA, T ;

KAKIZAKI, A ;

KONO, S .

SURFACE SCIENCE, 1995, 325 (1-2) :33-44

[2]

Ashcroft N. W., 1976, Solid State Physics

[3] Phonon dispersion of indium along [111] [J].

Bakulin, AS ;

Overhauser, AW ;

Kaiser, H ;

Werner, SA ;

Fernandez-Baca, JA ;

Smith, HG .

PHYSICAL REVIEW B, 2001, 63 (05)

[4] Origin of the different reconstructions of diamond, Si, and Ge(111) surfaces -: art. no. 016103 [J].

Bechstedt, F ;

Stekolnikov, AA ;

Furthmüller, J ;

Käckell, P .

PHYSICAL REVIEW LETTERS, 2001, 87 (01)

[5] Structure determination of the indium-induced Si(111)-(4 x 1) reconstruction by surface x-ray diffraction [J].

Bunk, O ;

Falkenberg, G ;

Zeysing, JH ;

Lottermoser, L ;

Johnson, RL ;

Nielsen, M ;

Berg-Rasmussen, F ;

Baker, J ;

Feidenhans'l, R .

PHYSICAL REVIEW B, 1999, 59 (19) :12228-12231

[6]

CARDONA M, 1982, TOP APPL PHYS, V50, P19

[7] Weakly correlated one-dimensional indium chains on Si(111) [J].

Cho, JH ;

Oh, DH ;

Kim, KS ;

Kleinman, L .

PHYSICAL REVIEW B, 2001, 64 (23)

[8] Phonon and polarized reflectance spectra from Si(111)-(4x1)In: Evidence for a charge-density-wave driven phase transition [J].

Fleischer, K ;

Chandola, S ;

Esser, N ;

Richter, W ;

McGilp, JF .

PHYSICAL REVIEW B, 2003, 67 (23)

[9] Ab initio calculation of the structure, electronic states, and the phonon dispersion of the Si(100) surface [J].

Fritsch, J ;

Pavone, P .

SURFACE SCIENCE, 1995, 344 (1-2) :159-173

[10] Extreme softening of Vanderbilt pseudopotentials:: General rules and case studies of first-row and d-electron elements [J].

Furthmüller, J ;

Käckell, P ;

Bechstedt, F ;

Kresse, G .

PHYSICAL REVIEW B, 2000, 61 (07) :4576-4587

← 1 2 3 →