Theoretical studies on nitrogen-oxygen complexes in silicon

被引:28
作者
Gali, A [1 ]
Miro, J [1 ]
Deak, P [1 ]
Ewels, CP [1 ]
Jones, R [1 ]
机构
[1] UNIV EXETER,DEPT PHYS,EXETER EX4 4QL,DEVON,ENGLAND
关键词
D O I
10.1088/0953-8984/8/41/016
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
Semi-empirical PM3 cluster calculations are used to show that stable, electrically active NO complexes may exist in silicon. Based on their relative stability with respect to oxygen and nitrogen pairs, the retardation of thermal double donor formation in the presence of nitrogen is explained, but an equilibrium concentration much less than that of NN pairs is predicted. It is also shown that interaction of NO with a single nitrogen atom creates a bistable NNO defect, while encounter with an oxygen or an NN pair preserves the electrical activity of the NO centre. The possible role of the NO complex in shallow thermal donor formation is discussed.
引用
收藏
页码:7711 / 7722
页数:12
相关论文
共 47 条
[1]  
AMMON WV, 1995, IN PRESS MATTER SC B
[2]   PREDICTION OF THE EFFECT OF THE SAMPLE BIASING IN SCANNING TUNNELING MICROSCOPY AND OF SURFACE-DEFECTS ON THE OBSERVED CHARACTER OF THE DIMERS IN THE SI(001)-(2X1) SURFACE [J].
BADZIAG, P ;
VERWOERD, WS ;
VANHOVE, MA .
PHYSICAL REVIEW B, 1991, 43 (03) :2058-2062
[3]  
BAIERLE RJ, 1996, IN PRESS THIN SOLID
[4]   GROUND-STATES OF MOLECULES .25. MINDO-3 - IMPROVED VERSION OF MINDO SEMIEMPIRICAL SCF-MO METHOD [J].
BINGHAM, RC ;
DEWAR, MJS ;
LO, DH .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1285-1293
[5]  
BOSSOMWORTH DR, 1970, P ROY SOC LOND A MAT, V317, P133
[6]   DEEP-LEVEL NITROGEN CENTERS IN LASER-ANNEALED ION-IMPLANTED SILICON [J].
BROWER, KL .
PHYSICAL REVIEW B, 1982, 26 (11) :6040-6052
[7]   FORMATION OF NITROGEN-OXYGEN DONORS IN N-DOPED CZOCHRALSKI-SILICON CRYSTAL [J].
CHEN, CS ;
LI, CF ;
YE, HJ ;
SHEN, SC ;
YANG, DR .
JOURNAL OF APPLIED PHYSICS, 1994, 76 (06) :3347-3350
[8]  
Claybourn M., 1989, Materials Science Forum, V38-41, P613, DOI 10.4028/www.scientific.net/MSF.38-41.613
[9]  
CRAIG BI, 1991, SURF SCI, V239, P36
[10]   EVALUATION OF SEMIEMPIRICAL QUANTUM-CHEMICAL METHODS IN SOLID-STATE APPLICATIONS .2. CYCLIC-CLUSTER CALCULATIONS OF SILICON [J].
DEAK, P ;
SNYDER, LC .
PHYSICAL REVIEW B, 1987, 36 (18) :9619-9627