Surface segregation and backscattering in doped silicon nanowires

被引:163
作者
Fernández-Serra, MV [1 ]
Adessi, C [1 ]
Blase, X [1 ]
机构
[1] Univ Lyon 1, CNRS, Lab Phys Mat Condense & Nanostruct, UMR 5586, F-69622 Villeurbanne, France
关键词
D O I
10.1103/PhysRevLett.96.166805
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
By means of ab initio simulations, we investigate the structural, electronic, and transport properties of boron and phosphorus doped silicon nanowires. We find that impurities always segregate at the surface of unpassivated wires, reducing dramatically the conductance of the surface states. Upon passivation, we show that for wires as large as a few nanometers in diameter, a large proportion of dopants will be trapped and electrically neutralized at surface dangling bond defects, significantly reducing the density of carriers. Important differences between p- and n-type doping are observed. Our results rationalize several experimental observations.
引用
收藏
页数:4
相关论文
共 38 条
[1]   Reduced backscattering in potassium-doped nanotubes:: Ab initio and semiempirical simulations [J].
Adessi, C ;
Roche, S ;
Blase, X .
PHYSICAL REVIEW B, 2006, 73 (12)
[2]   Paramagnetic defects of silicon nanowires [J].
Baumer, A ;
Stutzmann, M ;
Brandt, MS ;
Au, FCK ;
Lee, ST .
APPLIED PHYSICS LETTERS, 2004, 85 (06) :943-945
[3]   SURFACE DOPING AND STABILIZATION OF SI(111) WITH BORON [J].
BEDROSSIAN, P ;
MEADE, RD ;
MORTENSEN, K ;
CHEN, DM ;
GOLOVCHENKO, JA ;
VANDERBILT, D .
PHYSICAL REVIEW LETTERS, 1989, 63 (12) :1257-1260
[4]   Defects, quasibound states, and quantum conductance in metallic carbon nanotubes [J].
Choi, HJ ;
Ihm, J ;
Louie, SG ;
Cohen, ML .
PHYSICAL REVIEW LETTERS, 2000, 84 (13) :2917-2920
[5]   Learn on the fly:: A hybrid classical and quantum-mechanical molecular dynamics simulation -: art. no. 175503 [J].
Csányi, G ;
Albaret, T ;
Payne, MC ;
De Vita, A .
PHYSICAL REVIEW LETTERS, 2004, 93 (17) :175503-1
[6]   Functional nanoscale electronic devices assembled using silicon nanowire building blocks [J].
Cui, Y ;
Lieber, CM .
SCIENCE, 2001, 291 (5505) :851-853
[7]   High performance silicon nanowire field effect transistors [J].
Cui, Y ;
Zhong, ZH ;
Wang, DL ;
Wang, WU ;
Lieber, CM .
NANO LETTERS, 2003, 3 (02) :149-152
[8]   Diameter-controlled synthesis of single-crystal silicon nanowires [J].
Cui, Y ;
Lauhon, LJ ;
Gudiksen, MS ;
Wang, JF ;
Lieber, CM .
APPLIED PHYSICS LETTERS, 2001, 78 (15) :2214-2216
[9]   Doping and electrical transport in silicon nanowires [J].
Cui, Y ;
Duan, XF ;
Hu, JT ;
Lieber, CM .
JOURNAL OF PHYSICAL CHEMISTRY B, 2000, 104 (22) :5213-5216
[10]  
Datta S., 1995, ELECT TRANSPORT MESO