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We discuss the adiabatic self-trapping of small polarons within the density functional theory (DFT). In particular, we carried out plane-wave pseudo-potential calculations of the triplet exciton in NaCl and found no energy minimum…

Condensed Matter · Physics 2009-11-07 Jacob L. Gavartin , Peter V. Sushko , Alexander L. Shluger

Starting from a microscopic model, we investigate the optical spectra of molecules in strongly-coupled organic microcavities examining how they might self-consistently adapt their coupling to light. We consider both rotational and…

Mesoscale and Nanoscale Physics · Physics 2016-03-25 Justyna A. Cwik , Peter Kirton , Simone De Liberato , Jonathan Keeling

We consider the reduced dynamics of a molecular chain weakly coupled to a phonon bath. With a small and constant inhomogeneity in the coupling, the excitation relaxation rates are obtained in closed form. They are dominated by transitions…

Statistical Mechanics · Physics 2021-04-16 B. A. Tay

The optical conductivity of charge carriers coupled to quantum phonons is studied in the framework of the one-dimensional spinless Holstein model. For one electron, variational diagonalisation yields exact results in the thermodynamic…

Strongly Correlated Electrons · Physics 2007-06-13 Jan Loos , Martin Hohenadler , Andreas Alvermann , Holger Fehske

We study possible optically excited bound states in monolayer MoS2: excitons and trions. For this purpose we formulate and apply a generalized time-dependent density-matrix functional approach for bound states of multiple excitations. The…

Mesoscale and Nanoscale Physics · Physics 2014-02-18 Alfredo Ramirez-Torres , Volodymyr Turkowski , Talat S. Rahman

Saturation effects affecting absorption and fluorescence spectra of an atomic vapor confined in an Extremely Thin Cell (cell thickness $L < 1 \mu m$) are investigated experimentally and theoretically. The study is performed on the $D_{2}$…

Classical Physics · Physics 2009-11-13 C. Andreeva , S. Cartaleva , L. Petrov , S. M. Saltiel , D. Sarkisyan , T. Varzhapetyan , D. Bloch , M. Ducloy

We report on a theoretical investigation concerning the polaronic effect on the transport properties of a charge carrier in the one-dimensional molecular chain. Our technique is based on the Feynman's path integral approach. Analytical…

Mesoscale and Nanoscale Physics · Physics 2015-12-10 Sikarin Yoo-Kong , Watchara Liewrian

Living cells are characterized by the micrometric confinement of various macromolecules at high concentrations. Using droplets containing binary polymer blends as artificial cells, we previously showed that cell-sized confinement causes…

Atomically-thin transition metal dichalcogenide crystals (TMDCs) hold great promise for future semiconductor optoelectronics due to their unique electronic and optical properties. In particular, electron-hole pairs (excitons) in TMDCs are…

Mesoscale and Nanoscale Physics · Physics 2021-10-04 M. Wurdack , E. Estrecho , S. Todd , T. Yun , M. Pieczarka , S. K. Earl , J. A. Davis , C. Schneider , A. G. Truscott , E. A. Ostrovskaya

Cavity-polaritons in semiconductor microstructures have emerged as a promising system for exploring nonequilibrium dynamics of many-body systems. Key advances in this field, including the observation of polariton condensation,…

Mesoscale and Nanoscale Physics · Physics 2019-04-05 Aymeric Delteil , Thomas Fink , Anne Schade , Sven Höfling , Christian Schneider , Ataç Imamoğlu

Time-dependent density functional theory (TDDFT) has been applied to the calculation of absorption spectra for two-dimensional atomic layer materials. We reveal that the character of the first bright exciton state of bi-layer hexagonal…

Materials Science · Physics 2020-01-08 Yasumitsu Suzuki , Kazuyuki Watanabe

Density functional theory (DFT), the most widely adopted method in modern computational chemistry, fails to describe accurately the electronic structure of strongly correlated systems. Here we show that DFT can be formally and practically…

Chemical Physics · Physics 2022-04-18 Daniel Gibney , Jan-Niklas Boyn , David A. Mazziotti

We develop an analytic, fully field-theoretic description of how a hadronic medium can induce photon condensation in a cavity. Starting from leading-order Chiral Perturbation Theory minimally coupled to Maxwell theory, we construct a…

High Energy Physics - Theory · Physics 2026-03-09 Fabrizio Canfora , Mauricio Ipinza , Simon Riquelme

Unavoidable variations in size and position of the building blocks of photonic crystals cause light scattering and extinction of coherent beams. We present a new model for both 2 and 3-dimensional photonic crystals that relates the…

Optics · Physics 2007-05-23 A. Femius Koenderink , Ad Lagendijk , Willem L. Vos

Electrostriction, the deformation of dielectric materials under the influence of an electric field, is of continuous interest in optics. The classic experiment by Hakim and Higham [Proc. Phys. Soc. 80, 190 (1962)] for a stationary field…

It has been known for some time that the exchange-correlation potential in time-dependent density functional theory is an intrinsically nonlocal functional of the density as soon as one goes beyond the adiabatic approximation. In this paper…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Z. Qian , A. Constantinescu , G. Vignale

Optical excitations of molecular systems can be modified by their physical environment. We analyze the underlying mechanisms within many-body perturbation theory, which is particularly suited to study non-local polarizability effects on the…

Mesoscale and Nanoscale Physics · Physics 2012-03-09 Michael Rohlfing

The influence of solubilizing substitutional groups on the electronic and optical properties of functionalized pentacene molecules and crystals have been investigated. Density functional theory is used to calculate the electronic and…

Materials Science · Physics 2013-11-15 Y. Saeed , K. Zhao , N. Singh , R. Li , J. E. Anthony , A. Amassian , U. Schwingenschlögl

In the recent years we have seen a lot of activity around systems and experiments, like DIS at HERA or the heavy-ion experiments at RHIC, involving a large number of partons due to the high enery and/or the high number of participants of…

High Energy Physics - Phenomenology · Physics 2010-11-30 Elena G. Ferreiro

Spin dynamics of a single electron and an exciton confined in CdTe/ZnTe quantum dot is investigated by polarization-resolved correlation spectroscopy. Spin memory effects extending over at least a few tens of nanoseconds have been directly…

Other Condensed Matter · Physics 2008-06-07 J. Suffczynski , K. Kowalik , T. Kazimierczuk , A. Trajnerowicz , M. Goryca , P. Kossacki , A. Golnik , M. Nawrocki , J. A. Gaj
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