First-principles study of the compensation mechanism in N-doped ZnO

被引:51
作者
Lee, EC [1 ]
Kim, YS [1 ]
Jin, YG [1 ]
Chang, KJ [1 ]
机构
[1] Korea Adv Inst Sci & Technol, Dept Phys, Yusung Ku, Taejon 305701, South Korea
关键词
ZnO; nitrogen; compensation;
D O I
10.1016/S0921-4526(01)00838-9
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
Based on first-principles electronic structure calculations for N-related and native point defects in Zinc Oxide (ZnO), we propose a mechanism for the compensation of N acceptors. As compared to a normal N-2 source, the use of an active plasma N-2 gas generally increases the N solubility limit, because the N chemical potential is enhanced. However., whenever a pure N source is used, N acceptors are greatly compensated by donor defects, which may explain the difficulty in achieving low-resistance p-type ZnO. Major compensating donors for N acceptors are found to be different at low and high N doping levels, and also depend on the type of N-2 gas source. (C) 2001 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:912 / 915
页数:4
相关论文
共 15 条
[1]   Optically pumped lasing of ZnO at room temperature [J].
Bagnall, DM ;
Chen, YF ;
Zhu, Z ;
Yao, T ;
Koyama, S ;
Shen, MY ;
Goto, T .
APPLIED PHYSICS LETTERS, 1997, 70 (17) :2230-2232
[2]   FIRST-PRINCIPLES STUDY OF THE COMPENSATION MECHANISM FOR NITROGEN ACCEPTORS IN ZNSE [J].
CHEONG, BH ;
PARK, CH ;
CHANG, KJ .
PHYSICAL REVIEW B, 1995, 51 (16) :10610-10614
[3]   Magnetic properties of mn-doped ZnO [J].
Fukumura, T ;
Jin, ZW ;
Kawasaki, M ;
Shono, T ;
Hasegawa, T ;
Koshihara, S ;
Koinuma, H .
APPLIED PHYSICS LETTERS, 2001, 78 (07) :958-960
[4]   INHOMOGENEOUS ELECTRON-GAS [J].
RAJAGOPAL, AK ;
CALLAWAY, J .
PHYSICAL REVIEW B, 1973, 7 (05) :1912-1919
[5]   p-type electrical conduction in ZnO thin films by Ga and N codoping [J].
Joseph, M ;
Tabata, H ;
Kawai, T .
JAPANESE JOURNAL OF APPLIED PHYSICS PART 2-LETTERS & EXPRESS LETTERS, 1999, 38 (11A) :L1205-L1207
[6]   DEEP ENERGY-LEVELS OF DEFECTS IN THE WURTZITE SEMICONDUCTORS ALN, CDS, CDSE, ZNS, AND ZNO [J].
KOBAYASHI, A ;
SANKEY, OF ;
DOW, JD .
PHYSICAL REVIEW B, 1983, 28 (02) :946-956
[7]   First-principles study of native point defects in ZnO [J].
Kohan, AF ;
Ceder, G ;
Morgan, D ;
Van de Walle, CG .
PHYSICAL REVIEW B, 2000, 61 (22) :15019-15027
[8]   Compensation mechanism for N acceptors in ZnO [J].
Lee, EC ;
Kim, YS ;
Jin, YG ;
Chang, KJ .
PHYSICAL REVIEW B, 2001, 64 (08)
[9]   Residual native shallow donor in ZnO [J].
Look, DC ;
Hemsky, JW ;
Sizelove, JR .
PHYSICAL REVIEW LETTERS, 1999, 82 (12) :2552-2555
[10]   GROUP-III IMPURITY DOPED ZINC-OXIDE THIN-FILMS PREPARED BY RF MAGNETRON SPUTTERING [J].
MINAMI, T ;
SATO, H ;
NANTO, H ;
TAKATA, S .
JAPANESE JOURNAL OF APPLIED PHYSICS PART 2-LETTERS, 1985, 24 (10) :L781-L784