Benchmark of methods for azabenzenes

N Marom, F Caruso, X Ren, OT Hofmann… - Physical Review B …, 2012 - APS
Many-body perturbation theory in the GW approximation is a useful method for describing
electronic properties associated with charged excitations. A hierarchy of GW methods exists …

Thermal self-synchronization of nano-objects

Z Zhang, Y Guo, M Bescond, J Chen… - Journal of Applied …, 2021 - pubs.aip.org
Self-synchronization is a ubiquitous phenomenon in nature, in which oscillators are
collectively locked in frequency and phase through mutual interactions. While self …

Contact resistances in trigate and FinFET devices in a non-equilibrium Green's functions approach

L Bourdet, J Li, J Pelloux-Prayer, F Triozon… - Journal of Applied …, 2016 - pubs.aip.org
We compute the contact resistances R c in trigate and FinFET devices with widths and
heights in the 4–24 nm range using a Non-Equilibrium Green's Functions approach …

Modeling of phonon scattering in n-type nanowire transistors using one-shot analytic continuation technique

M Bescond, C Li, H Mera, N Cavassilas… - Journal of Applied …, 2013 - pubs.aip.org
We present a one-shot current-conserving approach to model the influence of electron-
phonon scattering in nano-transistors using the non-equilibrium Green's function formalism …

Convergence of quasiparticle band structures of Si and Ge nanowires in the approximation and the validity of scissor shifts

H Peelaers, B Partoens, M Giantomassi, T Rangel… - Physical Review B …, 2011 - APS
Starting from fully converged density-functional theory calculations, the quasiparticle
corrections are calculated for different sized Si and Ge nanowires using the GW …

Visualizing electron correlation by means of ab initio scanning tunneling spectroscopy images of single molecules

D Toroz, M Rontani, S Corni - The Journal of Chemical Physics, 2011 - pubs.aip.org
Scanning tunneling microscopy (STM) has been a fundamental tool to characterize many-
body effects in condensed matter systems, from extended solids to quantum dots. STM of …

Influence of the interface-induced electron self-energy on the subthreshold characteristics of silicon gate-all-around nanowire transistors

C Li, M Bescond, M Lannoo - Applied Physics Letters, 2010 - pubs.aip.org
The modeling of nanoscale semiconductor devices is usually performed in a self-consistent
Schrödinger–Poisson procedure. This letter reports an application of a more general …

Interacting resonant-level model with long-range interactions: Fast screening and suppression of the zero-bias conductance

E Perfetto, G Stefanucci, M Cini - Physical Review B—Condensed Matter and …, 2012 - APS
The effects of long-range interactions in quantum transport are still largely unexplored,
mainly due to the difficulty of devising efficient embedding schemes. In this work we present …

Image charge models for accurate construction of the electrostatic self-energy of 3D layered nanostructure devices

JR Barker, A Martinez - Journal of Physics: Condensed Matter, 2018 - iopscience.iop.org
Efficient analytical image charge models are derived for the full spatial variation of the
electrostatic self-energy of electrons in semiconductor nanostructures that arises from …

Self-synchronization of thermal phonons at equilibrium

Z Zhang, Y Guo, M Bescond, J Chen, M Nomura… - arXiv preprint arXiv …, 2020 - arxiv.org
Self-synchronization is a ubiquitous phenomenon in nature, in which oscillators are
collectively locked in frequency and phase through mutual interactions. While self …