Raman scattering study of zinc blende and wurtzite ZnS

被引：248

作者：

Cheng, Y. C. ^{[1
,2
]}

Jin, C. Q. ^{[1
,2
]}

Gao, F. ^{[1
,2
]}

Wu, X. L. ^{[1
,2
,3
]}

Zhong, W. ^{[1
,2
]}

Li, S. H. ^{[4
]}

Chu, Paul K. ^{[3
]}

机构：

[1] Nanjing Univ, Dept Phys, Nanjing 210093, Peoples R China

[2] Nanjing Univ, Natl Lab Solid State Microstruct, Nanjing 210093, Peoples R China

[3] City Univ Hong Kong, Dept Phys & Mat Sci, Kowloon, Hong Kong, Peoples R China

[4] Nanjing Univ, Lab Mesoscop Chem, Inst Theoret & Computat Chem, Dept Chem, Nanjing 210093, Peoples R China

来源：

JOURNAL OF APPLIED PHYSICS | 2009年 / 106卷 / 12期

关键词：

ab initio calculations; Brillouin zones; electronic density of states; II-VI semiconductors; phonons; Raman spectra; wide band gap semiconductors; zinc compounds; SELECTION RULES; PHONONS; CRYSTALS; DIAMOND; STATES;

D O I：

10.1063/1.3270401

中图分类号：

O59 [应用物理学];

学科分类号：

摘要：

We have conducted an experimental and theoretical study on first- and second-order Raman scattering of zinc blende and wurtzite ZnS. Based on the calculated phonon band structure, phonon density of states, and symmetry selection rules, we have clearly identified for the first time the origins of these vibration modes in the second-order Raman spectra from these two polymorphs. For zinc blende ZnS, it is found that the previously estimated frequency of the LA mode at X point in the Brillouin-zone boundary is much smaller than the value obtained from other experiments and our calculation. Considering the involvement of LA phonon at X point, we reassign the second-order Raman active modes and some other modes which have not yet been understood so far. This work clarifies some of the controversial Raman mode assignments in zinc blende and wurtzite ZnS.

引用

页数：5

共 22 条

[1] Phonons and related crystal properties from density-functional perturbation theory [J].

Baroni, S ;

de Gironcoli, S ;

Dal Corso, A ;

Giannozzi, P .

REVIEWS OF MODERN PHYSICS, 2001, 73 (02) :515-562

[2] SPACE GROUP SELECTION RULES - DIAMOND AND ZINC BLENDE [J].

BIRMAN, JL .

PHYSICAL REVIEW, 1962, 127 (04) :1093-&

[3] THEORY OF INFRARED AND RAMAN PROCESSES IN CRYSTALS - SELECTION RULES IN DIAMOND AND ZINCBLENDE [J].

BIRMAN, JL .

PHYSICAL REVIEW, 1963, 131 (04) :1489-+

[4] RAMAN EFFECT IN WURTZITE- AND ZINC-BLENDE-TYPE ZNS SINGLE CRYSTALS [J].

BRAFMAN, O ;

MITRA, SS .

PHYSICAL REVIEW, 1968, 171 (03) :931-&

[5] Optical and vibrational properties of 2H-, 4H-, and 6H-AlN: First-principle calculations [J].

Cheng, Y. C. ;

Chen, H. T. ;

Li, X. X. ;

Wu, X. L. ;

Zhu, J. ;

Li, S. H. ;

Chu, Paul K. .

JOURNAL OF APPLIED PHYSICS, 2009, 105 (08)

[6] Temperature dependence of raman scattering in ZnO [J].

Cusco, Ramon ;

Alarcon-Llado, Esther ;

Ibanez, Jordi ;

Artus, Luis ;

Jimenez, Juan ;

Wang, Buguo ;

Callahan, Michael J. .

PHYSICAL REVIEW B, 2007, 75 (16)

[7] Catalytic growth of clusters of wurtzite ZnS nanorods through co-deposition of ZnS and Zn on Au film [J].

Jin, Changqing ;

Cheng, Yingchun ;

Zhang, Xin ;

Zhong, Wei ;

Deng, Yu ;

Au, Chaktong ;

Wu, Xinglong ;

Du, Youwei .

CRYSTENGCOMM, 2009, 11 (11) :2260-2263

[8] First-principles calculation of vibrational Raman spectra in large systems:: Signature of small rings in crystalline SiO2 -: art. no. 036401 [J].

Lazzeri, M ;

Mauri, F .

PHYSICAL REVIEW LETTERS, 2003, 90 (03) :4

[9] Optical-phonon confinement and scattering in wurtzite heterostructures [J].

Lee, BC ;

Kim, KW ;

Stroscio, MA ;

Dutta, M .

PHYSICAL REVIEW B, 1998, 58 (08) :4860-4865

[10] The pressure-induced phase transition in SnO: a first-principles study [J].

Li, Y. W. ;

Li, Y. ;

Cui, T. ;

Zhang, L. J. ;

Ma, Y. M. ;

Zou, G. T. .

JOURNAL OF PHYSICS-CONDENSED MATTER, 2007, 19 (42)

← 1 2 3 →