Journal ArticleDOI
Computation of electrostatic fields in low-symmetry systems : application to stm configurations
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This article is published in Physical Review B.The article was published on 1996-05-15. It has received 26 citations till now. The article focuses on the topics: Spin polarized scanning tunneling microscopy & Physical optics.read more
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Electrostatic Interaction Model for the Calculation of the Polarizability of Large Noble Metal Nanoclusters
Lin Lin Jensen,Lasse Jensen +1 more
TL;DR: In this article, a capacitance-polarizability interaction model for describing the polarizability of large metal clusters is presented, which consists of interacting atomic capacitances and polarizabilities.
Journal ArticleDOI
Calculation of the energy loss for an electron passing near giant fullerenes
Luc Henrard,Ph. Lambin +1 more
TL;DR: In this paper, a theoretical analysis of the electron energy-loss spectra of isolated giant fullerenes is presented, using a macroscopic dielectric description of spherical onion-like fulrerenes and a discrete dipole approximation (DDA) framework.
Journal ArticleDOI
Molecular dynamics simulations of polarizable nanotubes interacting with water
TL;DR: In this paper, the authors used molecular dynamics simulations to quantify the response of a finite size polarizable nanotube to the electric field created by a water environment, leading to the evaluation of the energy and forces coming from the electrostatic interaction between the dipoles induced on the nanotubes by the water surrounding and the set of charges accounting for the permanent electric moments of these water molecules.
Journal ArticleDOI
Charge-dipole model to compute the polarization of fullerenes
TL;DR: In this article, a charge-dipole model for the calculation of the polarization of fullerenes and carbon nanotubes is presented, which is illustrated with a C720 fullerene and enables one to quantify the role of free charges.
Journal ArticleDOI
Influence of molecular adsorption on the dielectric properties of a single wall nanotube: a model sensor.
TL;DR: A self-consistent approach is developed to describe the variation of the linear dielectric susceptibility of the tube at the atomic scale when molecules are adsorbed at its external surface and shows striking agreement for most of the molecular species considered.
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