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Nonlocality and optics of inhomogeneous systems

Authors :
P. L. de Boeij
Christianus M.J. Wijers
Theoretical Chemistry
Zernike Institute for Advanced Materials
Source :
Journal of Chemical Physics, 116(1), 328-341. AMER INST PHYSICS
Publication Year :
2002

Abstract

Nonlocal interactions play a prominent role in the optics of inhomogeneous systems. Classical discrete dipole descriptions take into account only electro-magnetic nonlocality. This is insufficient to describe correctly the inhomogeneous optical response (e.g., reflectance anisotropy) for covalently bonded systems like semiconductor surfaces. For those systems also a prominent quantum mechanical nonlocality exists. In a cellular description this can be understood easily from the behavior of the wave function. For strongly bonded systems the wave function extends across cell boundaries and when cells are polarized, neighboring cells get polarized as well. This quantum induction introduces nonlocal polarizabilities in the description. The technical details how discrete dipole models have to be adapted to use nonlocal polarizabilities in finite systems and crystalline slabs and surfaces are given in this paper. The modified method is called discrete cellular method.

Details

Language :
English
ISSN :
00219606
Volume :
116
Issue :
1
Database :
OpenAIRE
Journal :
Journal of Chemical Physics
Accession number :
edsair.doi.dedup.....200e1d536781ac2fc0253c723fad1213