Sources of electrical conductivity in SnO2

被引:358
作者
Singh, Abhishek Kumar [1 ]
Janotti, Anderson [1 ]
Scheffler, Matthias [1 ,2 ]
Van de Walle, Chris G. [1 ]
机构
[1] Univ Calif Santa Barbara, Dept Mat, Santa Barbara, CA 93106 USA
[2] Max Planck Gesell, Fritz Haber Inst, D-14195 Berlin, Germany
关键词
D O I
10.1103/PhysRevLett.101.055502
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
SnO2 is widely used as a transparent conductor and sensor material. Better understanding and control of its conductivity would enhance its performance in existing applications and enable new ones, such as in light emitters. Using density functional theory, we show that the conventional attribution of n-type conductivity to intrinsic point defects is incorrect. Unintentional incorporation of hydrogen provides a consistent explanation of experimental observations. Most importantly, we find that SnO2 offers excellent prospects for p-type doping by incorporation of acceptors on the Sn site. Specific strategies for optimizing acceptor incorporation are presented.
引用
收藏
页数:4
相关论文
共 32 条
[1]   The surface and materials science of tin oxide [J].
Batzill, M ;
Diebold, U .
PROGRESS IN SURFACE SCIENCE, 2005, 79 (2-4) :47-154
[2]   RUTILE-TYPE COMPOUNDS .4. SIO2, GEO2 AND A COMPARISON WITH OTHER RUTILE-TYPE STRUCTURES [J].
BAUR, WH ;
KHAN, AA .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1971, B 27 (NOV15) :2133-&
[3]   PROJECTOR AUGMENTED-WAVE METHOD [J].
BLOCHL, PE .
PHYSICAL REVIEW B, 1994, 50 (24) :17953-17979
[4]   Predictor of p-type doping in II-VI semiconductors [J].
Chadi, DJ .
PHYSICAL REVIEW B, 1999, 59 (23) :15181-15183
[5]  
Dawar AL., 1995, Semiconducting Transparent Thin Films
[6]   ELECTRICAL PROPERTIES OF HIGH-QUALITY STANNIC OXIDE CRYSTALS [J].
FONSTAD, CG ;
REDIKER, RH .
JOURNAL OF APPLIED PHYSICS, 1971, 42 (07) :2911-&
[7]  
Geraldo Viviany, 2003, Mat. Res., V6, P451
[8]   Oxygen vacancies in ZnO [J].
Janotti, A ;
Van de Walle, CG .
APPLIED PHYSICS LETTERS, 2005, 87 (12) :1-3
[9]   Native point defects in ZnO [J].
Janotti, Anderson ;
Van de Walle, Chris G. .
PHYSICAL REVIEW B, 2007, 76 (16)
[10]   Absolute deformation potentials and band alignment of wurtzite ZnO, MgO, and CdO [J].
Janotti, Anderson ;
Van de Walle, Chris G. .
PHYSICAL REVIEW B, 2007, 75 (12)