Screening of point charges in Si quantum dots

被引:18
作者
Franceschetti, A [1 ]
Troparevsky, MC [1 ]
机构
[1] Oak Ridge Natl Lab, Oak Ridge, TN 37831 USA
来源
PHYSICAL REVIEW B | 2005年 / 72卷 / 16期
关键词
D O I
10.1103/PhysRevB.72.165311
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
The screening of a point charge in hydrogenated Si quantum dots ranging in diameter from 10 angstrom to 26 angstrom has been studied using first-principles density-functional theory in the local density approximation. We find that the main contribution to the screening function originates from the electrostatic field set up by the polarization charges at the surface of the nanocrystals. We show that this contribution is well described by a classical electrostatics model of dielectric screening.
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页数:4
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共 10 条
[1]   HYDROGENIC IMPURITY LEVELS, DIELECTRIC-CONSTANT, AND COULOMB CHARGING EFFECTS IN SILICON CRYSTALLITES [J].
ALLAN, G ;
DELERUE, C ;
LANNOO, M ;
MARTIN, E .
PHYSICAL REVIEW B, 1995, 52 (16) :11982-11988
[4]   Concept of dielectric constant for nanosized systems [J].
Delerue, C ;
Lannoo, M ;
Allan, G .
PHYSICAL REVIEW B, 2003, 68 (11)
[5]   Pseudopotential calculations of electron and hole addition spectra of InAs, InP, and Si quantum dots [J].
Franceschetti, A ;
Zunger, A .
PHYSICAL REVIEW B, 2000, 62 (04) :2614-2623
[6]   SCREENING IN SEMICONDUCTOR NANOCRYSTALLITES AND ITS CONSEQUENCES FOR POROUS SILICON [J].
LANNOO, M ;
DELERUE, C ;
ALLAN, G .
PHYSICAL REVIEW LETTERS, 1995, 74 (17) :3415-3418
[7]   Ab initio calculations for large dielectric matrices of confined systems -: art. no. 127401 [J].
Ögüt, S ;
Burdick, R ;
Saad, Y ;
Chelikowsky, JR .
PHYSICAL REVIEW LETTERS, 2003, 90 (12) :4
[8]   THOMAS-FERMI DIELECTRIC SCREENING IN SEMICONDUCTORS [J].
RESTA, R .
PHYSICAL REVIEW B, 1977, 16 (06) :2717-2722
[9]   SOFT SELF-CONSISTENT PSEUDOPOTENTIALS IN A GENERALIZED EIGENVALUE FORMALISM [J].
VANDERBILT, D .
PHYSICAL REVIEW B, 1990, 41 (11) :7892-7895
[10]   DIELECTRIC-CONSTANTS OF SILICON QUANTUM DOTS [J].
WANG, LW ;
ZUNGER, A .
PHYSICAL REVIEW LETTERS, 1994, 73 (07) :1039-1042