Calculating condensed matter properties using the KKR-Green's function method—recent developments and applications

H Ebert, D Koedderitzsch, J Minar - Reports on Progress in …, 2011 - iopscience.iop.org
The modern version of the KKR (Korringa–Kohn–Rostoker) method represents the
electronic structure of a system directly and efficiently in terms of its single-particle Green's …

Correlation, temperature and disorder: Recent developments in the one-step description of angle-resolved photoemission

J Braun, J Minár, H Ebert - Physics Reports, 2018 - Elsevier
Various apparative developments extended the potential of angle-resolved photoemission
spectroscopy tremendously during the last two decades. Modern experimental …

Exploring the XPS limit in soft and hard x-ray angle-resolved photoemission using a temperature-dependent one-step theory

J Braun, J Minár, S Mankovsky, VN Strocov… - Physical Review B …, 2013 - APS
We present a theory of temperature-dependent photoemission which accurately describes
phonon effects in soft and hard x-ray angle-resolved photoemission. Our approach is based …

Experimental reorganization energies of pentacene and perfluoropentacene: effects of perfluorination

S Kera, S Hosoumi, K Sato, H Fukagawa… - The Journal of …, 2013 - ACS Publications
Electron–phonon coupling of the highest occupied molecular orbital (HOMO) state is studied
by high-resolution ultraviolet photoelectron spectroscopy (UPS) for pentacene (PEN) and …

Increased X-ray attenuation efficiency of graphene-based nanocomposite

J Viegas, LA Silva, AMS Batista… - Industrial & …, 2017 - ACS Publications
We report an enhanced X-ray shielding effect related to graphene. The mass attenuation
coefficients measured for nanocomposites made of poly (vinylidene fluoride)(PVDF) filled …

Enhanced X-ray shielding effects of carbon nanotubes

T Fujimori, S Tsuruoka, B Fugetsu… - Materials …, 2011 - ingentaconnect.com
We report an explicit phenomenon related to the X-ray attenuation inherent to carbon
nanotubes (CNTs). We observed that the mass attenuation coefficient of CNTs was …

Impact of molecular orbital distribution on photoelectron intensity for picene film

Y Liu, D Ikeda, S Nagamatsu, T Nishi, N Ueno… - Journal of Electron …, 2014 - Elsevier
The recent development in the theoretical evaluation of photoelectron intensity from π-
electronic states delocalized over a molecule is discussed. By comparing the experimental …

Fermi level determination in tin oxide by photoelectron spectroscopy: Relation to optoelectronic properties; Band bending at surfaces and interfaces; modulation …

M Weidner - 2016 - tuprints.ulb.tu-darmstadt.de
This study is concerned with correlating the macroscopic optoelectronic properties of SnO2
tin oxide, a transparent conducting oxide, with its microscopic morphology and electronic …

13 Theoretical Description of ARPES: The One-Step Model

J Minar - DMFT at 25: Infinite Dimensions, 2014 - books.google.com
13 Theoretical Description of ARPES: The One-Step Model Page 385 13 Theoretical Description
of ARPES: The One-Step Model Jan Minar Department Chemie, Physikalische Chemie …

Many-body photoemission theory for organic molecular crystals

M Nozaki, M Haniuda, K Niki, T Fujikawa… - Journal of Electron …, 2021 - Elsevier
A many-body photoemission theory based on Keldysh nonequilibrium Green's functions is
developed and applied to photoemission from extended states of organic molecules and …