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The exploring and understanding the electronic properties of molecules connected to metallic leads is a vital part of nanoscience if molecule is to have a future. This thesis documents a study for various families of organic and…

Computational Physics · Physics 2016-12-13 Oday A. Al-Owaedi

Hamiltonian of a parametric process describing the interaction of a finite number of optical cavity modes, with the microwave field is proposed. Three-boson interaction is due to electro-optical effect. Analysis of the model is based on the…

Quantum Physics · Physics 2015-04-08 G. P. Miroshnichenko , A. Gleim

Since electronic and magnetic properties of many transition-metal oxides can be efficiently controlled by external factors such as the temperature, pressure, electric or magnetic field, they are regarded as promising materials for various…

Strongly Correlated Electrons · Physics 2015-05-18 I. V. Solovyev

The optical activity tensor (OAT) is explicitly derived. It is shown that to evaluate a large number of effects related to optical activity of some atomic/molecular system at arbitrary frequency $\omega$ of the incident light, one needs to…

Atomic and Molecular Clusters · Physics 2010-10-26 Alexei M. Frolov , David M. Wardlaw

We report an interpretation method for deep learning models that allows us to handle high-dimensional spectral data in materials science. The proposed method uses feature extraction and clustering analysis to categorize materials into…

Materials Science · Physics 2025-10-21 Akira Takahashi , Yu Kumagai , Arata Takamatsu , Fumiyasu Oba

The problem of light waves interaction with charged particles becomes more and more complex starting with the case of plane waves, where the analytical solution is well known, to more natural, though more complicated situations which…

Plasma Physics · Physics 2024-07-22 Egor Dmitriev , Philipp Korneev

There is an increasing interest in the amorphous states of metal-organic frameworks (MOFs) and porous coordination polymers, which can be produced by pressure-induced amorphization, temperature-induced amorphization, melt-quenching,…

Materials Science · Physics 2022-06-20 Nicolas Castel , François-Xavier Coudert

There is a pressing need for more accurate computational simulations of the opto-electronic properties of defects in materials to aid in the development of quantum sensing platforms. In this work, we explore how quantum computers could be…

The paper presents an integrated view of the population structure and its role in establishing the ionisation state of light elements in dynamic, finite density, laboratory and astrophysical plasmas. There are four main issues, the…

Silicon Photomultipliers are potentially ideal detectors for Quantum Optics and Quantum Information studies based on mesoscopic states of light. However, their non-idealities hampered their use so far. An optimal mode of operation has been…

The nonlinear component of the optomechanical interaction between light and mechanical vibration promises many exciting classical and quantum mechanical applications, but is generally weak. Here we demonstrate enhancement of nonlinear…

Quantum Physics · Physics 2023-03-21 Roel Burgwal , Ewold Verhagen

Understanding the nature of strongly correlated states in flat-band materials (such as moir\'e heterostructures) is at the forefront of both experimental and theoretical pursuits. While magnetotransport, scanning probe, and optical…

Mesoscale and Nanoscale Physics · Physics 2022-12-05 Michał Papaj , Cyprian Lewandowski

The dominantly orbital state method allows a semiclassical description of quantum systems. At the origin, it was developed for two-body relativistic systems. Here, the method is extended to treat two-body Hamiltonians and systems with three…

Quantum Physics · Physics 2013-06-07 Claude Semay , Fabien Buisseret

Optoionics, a promising new field that aims at controlling ion dynamics using light, links photovoltaic power generation with electrochemical charge storage. This has the potential to drive and accelerate the energy revolution by utilizing…

Materials Science · Physics 2025-03-11 Matteo Rinaldi , Matthias Kick , Karsten Reuter , Christian Carbogno

Predicting optoelectronic properties of large-scale atomistic systems under realistic conditions is crucial for rational materials design, yet computationally prohibitive with first-principles simulations. Recent neural network models have…

Materials Science · Physics 2026-02-10 Martin Schwade , Shaoming Zhang , Frederik Vonhoff , Frederico P. Delgado , David A. Egger

Optical emitters strongly coupled to photons propagating in one-dimensional waveguides are a promising platform for optical quantum information processing. Here, we present a theoretical study of the scattering of two indistinguishable…

Quantum Physics · Physics 2016-03-24 Alexandre Roulet , Huy Nguyen Le , Valerio Scarani

Numerical calculation of modes in dispersive and absorptive systems is performed using the finite element method. The dispersion is tackled in the frame of an extension of Maxwell's equations where auxiliary fields are added to the…

Optics · Physics 2016-04-20 Yoann Brûlé , Guillaume Demésy , Boris Gralak

The Zintl-Klemm concept has long been used to explain and predict the bonding, and thereby the structures, of crystalline solid-state materials. We apply this concept to the amorphous state, examining as an example the diverse disordered…

Materials Science · Physics 2025-04-08 Litong Wu , Volker L. Deringer

Using carefully designed hybrid metal-dielectric resonators, we study molecular optomechanics in the strong coupling regime ($g_{\rm }^2/\omega_m {>} \kappa$), which manifests in anharmonic emission lines in the sideband-resolved region of…

Mesoscale and Nanoscale Physics · Physics 2019-11-28 Mohsen Kamandar Dezfouli , Reuven Gordon , Stephen Hughes

Plasmonic resonances in metallic nanoparticles are exploited to create efficient optical filtering functions. A Finite Element Method is used to model metallic nanoparticles gratings. The accuracy of this method is shown by comparing…