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@PHDTHESIS{Gehlmann:849597,
author = {Gehlmann, Mathias},
title = {{T}he electronic structure of transition metal
dichalcogenides investigated by angle-resolved photoemission
spectroscopy},
volume = {170},
school = {Universität Duisburg},
type = {Dr.},
address = {Jülich},
publisher = {Forschungszentrum Jülich GmbH Zentralbibliothek, Verlag},
reportid = {FZJ-2018-03776},
isbn = {978-3-95806-324-2},
series = {Schriften des Forschungszentrums Jülich. Reihe
Schlüsseltechnologien / Key Technologies},
pages = {II, 108, 1-XVIII S.},
year = {2018},
note = {Universität Duisburg, Diss., 2018},
abstract = {Van der Waals (vdW) materials offer a perspective to
revolutionize basically every facet of nowadays technology
with a new generation of atomically thin devices. Transition
metal dichalcogenides (TMDCs) are a family of vdW crystals,
that includes several semiconducting materials with band
gaps within the optical range. This makes them ideal for
numerous applications such as transistors, optical sensors,
solar cells, and LEDs. In this study we focuses on two
members of the TMDC family: molybdenum disufide (MoS$_{2}$)
and rhenium disulfide (ReS$_{2}$). Using a combination of
angle-resolved photoemission spectroscopy (APRES) with
density functional theory (DFT), we provide a thorough
analysis of the electronic band structure of these two
exceptional materials. In monolayers of MoS$_{2}$ the
combination of broken inversion symmetry with the heavy
element molybdenum leads to a large spin-splitting of
distinct valleys within its electronic structure. Therefore,
MoS$_{2}$ combines the essential ingredients for socalled
$\textit{spintronics}$ and $\textit{valleytronics}$. It was
generally believed that these fascinating features are
forbidden in MoS$_{2}$ bulk crystals due to their
centrosymmetric space group. This study demonstrates that
the strong confinement of the valleys within the vdW layers
leads to a recently discovered type of $\textit{hidden
spin-polarization}$, which results in quasi two-dimensional,
highly spin-polarized states in this centrosymmetricbulk
crystal. Furthermore, we present the first ARPES study of
ReS$_{2}$ bulk, monolayer, and bilayer crystals. Recent
literature reported indications for a total confinement of
the bulk electronic structure within the plains of the vdW
layers. Our study comes to the opposite conclusion. Based on
the observation of a considerable out-of-plane dispersion in
the ARPES experiments, as well as in the band structure
calculations, we show that valence electrons are
significantly delocalized across the vdW gap. In addition,
we identify the valence band maximum of bulk, monolayer, and
bilayer ReS$_{2}$ experimentally. The combination of ARPES
and band structure calculations shows that ReS$_{2}$
undergoes a transition from a direct band gap in the bulk
and bilayer to an indirect gap in the monolayer.},
cin = {PGI-6},
cid = {I:(DE-Juel1)PGI-6-20110106},
pnm = {899 - ohne Topic (POF3-899)},
pid = {G:(DE-HGF)POF3-899},
typ = {PUB:(DE-HGF)3 / PUB:(DE-HGF)11},
url = {https://juser.fz-juelich.de/record/849597},
}