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The low temperature electron-phonon (e-ph) relaxation near the surface of noble metals, Cu and Ag, is studied by using the density-functional theory approach. The appearance of the surface phonon mode can give rise to a strong enhancement…

Materials Science · Physics 2020-05-20 Shota Ono

The formation of extended electron states in one-dimensional nanostructures is of key importance for the function of molecular electronics devices. Here we study the effects of strong electron-phonon interaction on the formation of extended…

Mesoscale and Nanoscale Physics · Physics 2018-10-09 Bruno Schuler , Mats Persson , Sami Paavilainen , Niko Pavliček , Leo Gross , Gerhard Meyer , Jascha Repp

We have studied the lattice dynamics, electron-phonon coupling, and superconducting properties of $\alpha$-MoB$_2$, as a function of applied pressure, within the framework of density functional perturbation theory using a mixed-basis…

Superconductivity · Physics 2023-10-31 Marco-Antonio Carmona-Galván , Rolf Heid , Omar De la Peña-Seaman

We investigate the dynamical effects of electron-phonon coupling (EPC) on the superconducting properties of two-dimensional (2D) systems, calculating the Eliashberg function in terms of dynamically renormalized phonons. By studying…

Superconductivity · Physics 2025-04-29 Juraj Krsnik , Dino Novko , Osor Slaven Barišić

The influence of local oxidation in silicon nanowires on hole transport, and hence the effect of varying the oxidation state of silicon atoms at the wire surface, is studied using density functional theory in conjunction with a Green's…

Materials Science · Physics 2010-02-03 Giorgos Fagas , James C. Greer

The scattering of the eletron by a domain wall in a nano-wire is studied perturbatively to the lowest order. The correction to the thermodaynamic potential of the electron system due to the scattering is calculated from the phase shift. The…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 Gen Tatara , Yasuhiro Tokura

We have studied Peierls instability in an atomically thin wire of sodium atoms using first-principles density-functional methods. A Na wire has a stable uniform linear structure over a range of inter-atomic distances. At smaller…

Materials Science · Physics 2009-11-11 Prasenjit Sen

Bandstructure effects in the electronic transport of strongly quantized silicon nanowire field-effect-transistors (FET) in various transport orientations are examined. A 10-band sp3d5s* semi-empirical atomistic tight-binding model coupled…

Materials Science · Physics 2009-11-13 Neophytos Neophytou , Abhijeet Paul , Mark Lundstrom , Gerhard Klimeck

Photons and electrons transmit information to form complex systems and networks. Phonons on the other hand, the quanta of mechanical motion, are often considered only as carriers of thermal energy. Nonetheless, their flow can also be molded…

Electron relaxation, induced by acoustic phonons, is studied for coupled quantum rings in the presence of external fields, both electric and magnetic. We address the problem of a single electron in vertically coupled GaAs quantum rings.…

Other Condensed Matter · Physics 2009-11-13 G. Piacente , G. Q. Hai

Electromagnetic response of a finite-width two-dimensional electron stripe with attached metallic side contacts is theoretically studied. It is shown that contacts substantially influence the position, the linewidth, and the amplitude of…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 S. A. Mikhailov , N. A. Savostianova

We consider a polaron model where molecular \emph{rotations} are important. Here, the usual hopping between neighboring sites is affected directly by the electron-phonon interaction via a {\em twist-dependent} hopping amplitude. This model…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 Wei Zhang , Alexander O. Govorov , Sergio E. Ulloa

Electron-phonon interaction and phonon frequencies of doped polar semiconductors are sensitive to long-range Coulomb forces and can be strongly affected by screening effects of free carriers, the latter changing significantly when…

Materials Science · Physics 2025-06-10 Francesco Macheda , Thibault Sohier , Paolo Barone , Francesco Mauri

Silicon nanowires have attracted considerable interest due to their wide-ranging applications in nanoelectromechanical systems and nanoelectronics. Molecular dynamics simulations are powerful tools for studying the mechanical properties of…

Materials Science · Physics 2023-08-25 Sina Zare Pakzad , Mohammad Nasr Esfahani , B. Erdem Alaca

Hybrid polymer-plasmonic nanostructures might combine high enhancement of localized fields from metal nanoparticles with light confinement and long-range transport in subwavelength dielectric structures. Here we report on the complex…

The electronic and magneto transport properties of reduced anatase TiO2 epitaxial thin films are analyzed considering various polaronic effects. Unexpectedly, with increasing carrier concentration, the mobility increases, which rarely…

Mesoscale and Nanoscale Physics · Physics 2023-03-07 B. X. Yan , D. Y. Wan , X. Chi , C. J. Li , M. R. Motapothula , S. Hooda , P. Yang , Z. Huang , S. W. Zeng , A. Gadekar , S. J. Pennycook , A. Rusydi , Ariando , J. Martin , T. Venkatesan

A density functional theory study of the structural and electronic properties and relative stability of narrow SP3 silicon nanotubes of different growth orientations is presented. All nanotubes studied and their corresponding wire…

Mesoscale and Nanoscale Physics · Physics 2012-12-05 Alon Hever , Jonathan Bernstein , Oded Hod

Using density functional theory (DFT) and density functional perturbation theory (DFPT), the band structure, phonon dispersion and electron phonon coupling matrix were calculated for silicon (Si), diamond and cubic boron nitride (cBN). From…

Materials Science · Physics 2025-02-18 Patrick Williams , Angela Dyson

The electronic and vibrational properties and electron-phonon couplings of one-dimensional materials will be key to many prospective applications in nanotechnology. Dimensionality strongly affects these properties and has to be correctly…

Materials Science · Physics 2023-10-09 Norma Rivano , Nicola Marzari , Thibault Sohier

We demonstrate full suppression of dephasing tied to deformation potential coupling of confined electrons to longitunidal acoustic (LA) phonons in optical control experiments on large semiconductor quantum dots (QDs) with emission…

Mesoscale and Nanoscale Physics · Physics 2020-12-07 A. Ramachandran , G. R. Wilbur , S. O'Neal , D. G. Deppe , K. C. Hall