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Numerical modeling of electromagnetic waves is an important tool for understanding the interaction of light and matter, and lies at the core of computational electromagnetics. Traditional approaches to injecting and evolving electromagnetic…

Computational Physics · Physics 2023-07-12 K. Weichman , K. G. Miller , B. Malaca , W. B. Mori , J. R. Pierce , D. Ramsey , J. Vieira , M. Vranic , J. P. Palastro

We present an approach for generating local numerical basis sets of improving accuracy for first-principles nanoplasmonics simulations within time-dependent density functional theory. The method is demonstrated for copper, silver, and gold…

Materials Science · Physics 2015-09-04 Tuomas P. Rossi , Susi Lehtola , Arto Sakko , Martti J. Puska , Risto M. Nieminen

In simulations of metallic interfaces, a critical aspect of metallic behavior is missing from the some of the most widely used classical molecular dynamics force fields. We present a modification of the embedded atom method (EAM) which…

Materials Science · Physics 2019-04-02 Hemanta Bhattarai , Kathie E. Newman , J. Daniel Gezelter

The specificity of modal-expansion formalisms is their capabilities to model the physical properties in the natural resonance-state basis of the system in question, leading to a transparent interpretation of the numerical results. In…

Optics · Physics 2018-09-06 Wei Yan , Rémi Faggiani , Philippe Lalanne

The structure and function of biological molecules are strongly influenced by the water and dissolved ions that surround them. This aqueous solution (solvent) exerts significant electrostatic forces in response to the biomolecule's…

Numerical Analysis · Mathematics 2015-12-29 Matthew G. Knepley , Jaydeep P. Bardhan

We present a theoretical study of the radiative and nonradiative decay rates of an optical emitter in close proximity to a prolate-shaped metal nanoparticle. We use the model developed by Gersten and Nitzan, that we correct for radiative…

Other Condensed Matter · Physics 2007-11-13 H. Mertens , A. Polman

The optical properties of particulate-matter aerosols, within the context of exoplanet and brown dwarf atmospheres, are compared using three different models: Mie theory, Modified Mean Field (MMF) Theory, and Discrete Dipole Approximation…

Earth and Planetary Astrophysics · Physics 2023-12-06 Matt G. Lodge , Hannah R. Wakeford , Zoe M. Leinhardt

We develop a computational method for modeling electrostatic interactions of arbitrarily-shaped, polarizable objects on colloidal length scales, including colloids/nanoparticles, polymers, and surfactants, dispersed in explicit ion…

Soft Condensed Matter · Physics 2024-06-18 Emily Krucker-Velasquez , James W. Swan , Zachary Sherman

This paper presents an analytical framework, based on Floquet modal expansions of the electromagnetic fields and equivalent circuits, to model reconfigurable metasurfaces loaded with generic lumped elements (resistors, capacitors,…

We develop a simple and reliable analytical model that allows describing the electromagnetic response of all-dielectric metasurfaces consisting of a single-layer array of high-permittivity spherical particles. By combining Mie theory with a…

Classical Physics · Physics 2020-12-21 Alessio Monti , Andrea Alù , Alessandro Toscano , Filiberto Bilotti

High-resolution simulations of particle-based kinetic plasma models typically require a high number of particles and thus often become computationally intractable. This is exacerbated in multi-query simulations, where the problem depends on…

Numerical Analysis · Mathematics 2023-07-10 Jan S. Hesthaven , Cecilia Pagliantini , Nicolò Ripamonti

A simple and robust method able to predict, with high accuracy, the optical properties of single and multi-layer nanostructures is presented. The method exploits a COMSOL Multiphysics simulation platform and it has been validated by three…

Applied Physics · Physics 2020-06-16 Giuseppe Emanuele Lio , Giovanna Palermo , Roberto Caputo , Antonio De Luca

We investigate theoretically and numerically the coupling between elastic and localized surface plasmon modes in a system of gold nanocylinders separated from a thin gold film by a dielectric spacer of few nanometers thickness. That system…

Focusing electromagnetic energy to sub-wavelength dimensions has become an increasingly active field of research for a variety of applications such as Heat Assisted Magnetic Recording (HAMR), nanolithography, and nanoscale optical…

Metallic nanoparticles embedded in dielectrics permit enhanced capture of light at specific wavelengths through excitation of plasmons, i.e. the quanta of coherent and collective oscillations of large concentrations of nearly free…

Materials Science · Physics 2010-01-19 J. Trice , C. Favazza , H. Garcia , R. Sureshkumar , R. Kalyanaraman

Recent advances in nano-fabrication techniques allow for the manufacture of optical metamaterials, bringing their unique and extra-ordinary properties to the visible regime and beyond. However, an analytical description of optical…

Optics · Physics 2015-06-15 Angela Demetriadou , Ortwin Hess

This paper is concerned with efficient representations and approximations of the solution to the scattering problem by a system of strongly coupled plasmonic particles. Three schemes are developed: the first is the resonant expansion which…

Numerical Analysis · Mathematics 2017-09-26 Habib Ammari , Matias Ruiz , Sanghyeon Yu , Hai Zhang

Collective optical excitations, such as localized surface plasmons in metallic nanoparticles and Mie resonances in high-index dielectrics, play a central role in nanoscale light--matter interactions. When such optical modes interact with…

I present a direct and intuitive eigenmode method that evaluates the near-field enhancement around the surface of metallic nanoparticles of arbitrary shape. The method is based on the boundary integral equation in the electrostatic limit.…

Mesoscale and Nanoscale Physics · Physics 2013-05-30 Titus Sandu

The validation of embedded atom models (EAM) for modelling nanoalloys requires to verify both a faithful description of the individual phases and a convincing scheme for the mixed interactions. In this work, we present a systematic…

Chemical Physics · Physics 2019-08-27 Marta Bon , Nabeel Ahmad , Rolf Erni , Daniele Passerone