The GW Compendium: A Practical Guide to Theoretical Photoemission Spectroscopy

D Golze, M Dvorak, P Rinke - Frontiers in chemistry, 2019 - frontiersin.org
The GW approximation in electronic structure theory has become a widespread tool for
predicting electronic excitations in chemical compounds and materials. In the realm of …

Electron-phonon interactions from first principles

F Giustino - Reviews of Modern Physics, 2017 - APS
This article reviews the theory of electron-phonon interactions in solids from the point of view
of ab initio calculations. While the electron-phonon interaction has been studied for almost a …

Giant bandgap renormalization and excitonic effects in a monolayer transition metal dichalcogenide semiconductor

MM Ugeda, AJ Bradley, SF Shi, FH Da Jornada… - Nature materials, 2014 - nature.com
Abstract Two-dimensional (2D) transition metal dichalcogenides (TMDs) are emerging as a
new platform for exploring 2D semiconductor physics,,,,,,,,. Reduced screening in two …

GW100: Benchmarking G0W0 for Molecular Systems

MJ Van Setten, F Caruso, S Sharifzadeh… - Journal of chemical …, 2015 - ACS Publications
We present the GW 100 set. GW 100 is a benchmark set of the ionization potentials and
electron affinities of 100 molecules computed with the GW method using three independent …

25th anniversary article: chemically modified/doped carbon nanotubes & graphene for optimized nanostructures & nanodevices

UN Maiti, WJ Lee, JM Lee, Y Oh, JY Kim… - Advanced …, 2014 - Wiley Online Library
Outstanding pristine properties of carbon nanotubes and graphene have limited the scope
for real‐life applications without precise controllability of the material structures and …

Colloquium: Graphene spectroscopy

DN Basov, MM Fogler, A Lanzara, F Wang… - Reviews of Modern Physics, 2014 - APS
Spectroscopic studies of electronic phenomena in graphene are reviewed. A variety of
methods and techniques are surveyed, from quasiparticle spectroscopies (tunneling …

Plasmon modes in graphene: status and prospect

A Politano, G Chiarello - Nanoscale, 2014 - pubs.rsc.org
Plasmons in graphene have unusual properties and offer promising prospects for plasmonic
applications covering a wide frequency range, ranging from terahertz up to the visible …

Origin of the crossover from polarons to Fermi liquids in transition metal oxides

C Verdi, F Caruso, F Giustino - Nature Communications, 2017 - nature.com
Transition metal oxides host a wealth of exotic phenomena ranging from charge, orbital and
magnetic order to nontrivial topological phases and superconductivity. In order to translate …

Accurate Absolute and Relative Core-Level Binding Energies from GW

D Golze, L Keller, P Rinke - The journal of physical chemistry …, 2020 - ACS Publications
We present an accurate approach to compute X-ray photoelectron spectra based on the GW
Green's function method that overcomes the shortcomings of common density functional …

Quasiparticle and Optical Properties of Carrier-Doped Monolayer MoTe2 from First Principles

A Champagne, JB Haber, S Pokawanvit, DY Qiu… - Nano Letters, 2023 - ACS Publications
The intrinsic weak and highly nonlocal dielectric screening of two-dimensional materials is
well-known to lead to high sensitivity of their optoelectronic properties to environment. Less …