Markus Donath
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Markus Donath has a total of 92 co-authors. Here are the top co-authors by number of shared publications:
- Anke B. Schmidt
Physikalisches Institut, Westfälische Wilhelms-Universität Münster, Wilhelm-Klemm-Straße 10, 48149 Münster, Germany
8 shared publications Peter Krüger
Institut für Festkörpertheorie, University of Münster, Wilhelm-Klemm-Straße 10, 48149 Münster, Germany
6 shared publications- Peter Krüger
Universität Münster
6 shared publications - Taichi Okuda
Hiroshima University
5 shared publications - Fabian Schöttke
Universität Münster
4 shared publications - Marcel Holtmann
Physikalisches Institut, Universität Münster , Wilhelm-Klemm-Str. 10, 48149 Münster
4 shared publications
Latest Publications
- Open Access
- 4 September 2026
- Published by American Physical Society (APS) in Physical Review B
- Vol. 114 (18)
Sign of the Rashba parameter in image-potential states
Image-potential surface states are simple model systems, where spin-dependent effects can be studied in view of spintronic applications. The Rashba effect in surface states at high- Z materials is related to both the strong spin-orbit interaction in heavy atoms and the orbital angular momentum arising from the inversion-symmetry breaking at the surface. Our study on image-potential states at Bi 2 Se 3 and Bi 2 Te 3 showcases that the orbital angular momentum causes an intrinsically reversed Rashba parameter α R ≈ − 100 meV Å , i.e., a reversed spin splitting compared with the prototypical Rashba-split Au(111) crystal-induced surface state. We present a consistent picture of spin-resolved experimental data from inverse photoemission and three-photon photoemission together with calculations from density-functional theory and many-body perturbation theory.
- 4 September 2026
- Published by American Physical Society (APS) in Physical Review B
- Vol. 114 (18)
Open AccessSign of the Rashba parameter in image-potential states
Image-potential surface states are simple model systems, where spin-dependent effects can be studied in view of spintronic applications. The Rashba effect in surface states at high- Z materials is related to both the strong spin-orbit interaction in heavy atoms and the orbital angular momentum arising from the inversion-symmetry breaking at the surface. Our study on image-potential states at Bi 2 Se 3 and Bi 2 Te 3 showcases that the orbital angular momentum causes an intrinsically reversed Rashba parameter α R ≈ − 100 meV Å , i.e., a reversed spin splitting compared with the prototypical Rashba-split Au(111) crystal-induced surface state. We present a consistent picture of spin-resolved experimental data from inverse photoemission and three-photon photoemission together with calculations from density-functional theory and many-body perturbation theory.
- Open Access
- 4 December 2025
- Published by American Physical Society (APS) in Physical Review B
- Vol. 112 (23)
Transition metal dichalcogenide surfaces as scattering targets in spin-polarization detectors: A case study of MoS 2
The suitability of transition metal dichalcogenides (TMDCs) for the use as scattering targets in electron spin-polarization detectors is put to a paradigmatic test: a case study of MoS 2 is performed. Therefore, the electron reflectivity, the Sherman function, and the figure of merit are measured for the following samples: a single layer of MoS 2 on Au(111) and cleaved MoS 2 single-crystal surfaces. MoS 2 offers promising features for the use in spin-polarization detection: working points with a reversed sign of the Sherman function and a long-term target stability. To overcome the low figure of merit of MoS 2 , the closely-related 2D material WS 2 with higher spin-orbit interaction is proposed, which may resemble the promising features with higher Sherman function. This study demonstrates the potential suitability of 2D materials such as TMDCs as scattering targets in spin-polarization detectors.
- 4 December 2025
- Published by American Physical Society (APS) in Physical Review B
- Vol. 112 (23)
Open AccessTransition metal dichalcogenide surfaces as scattering targets in spin-polarization detectors: A case study of MoS 2
The suitability of transition metal dichalcogenides (TMDCs) for the use as scattering targets in electron spin-polarization detectors is put to a paradigmatic test: a case study of MoS 2 is performed. Therefore, the electron reflectivity, the Sherman function, and the figure of merit are measured for the following samples: a single layer of MoS 2 on Au(111) and cleaved MoS 2 single-crystal surfaces. MoS 2 offers promising features for the use in spin-polarization detection: working points with a reversed sign of the Sherman function and a long-term target stability. To overcome the low figure of merit of MoS 2 , the closely-related 2D material WS 2 with higher spin-orbit interaction is proposed, which may resemble the promising features with higher Sherman function. This study demonstrates the potential suitability of 2D materials such as TMDCs as scattering targets in spin-polarization detectors.
- Open Access
- 19 August 2025
- Published by IOP Publishing in Measurement Science and Technology
- Vol. 36 (9)
Optimized VUV-photon detection with acetone/CaF2 proportional counters for use in inverse photoemission
The detection of vacuum-ultraviolet photons in inverse-photoemission experiments is usually carried out with gas-filled counting tubes. Iodine/argon gas fillings have been used for Geiger-Müller-type photon detection. Later, the gas filling was replaced by acetone to increase stability and the operation was changed to proportional mode. While doing this, the counting tube geometry was not necessarily changed. We carried out a systematic study to understand the photon-detection process in acetone-filled counting tubes and to optimize the geometry accordingly. In the range of optimal gas pressures, we found that the photon mean free path in acetone is in the order of a few millimeters instead of a few centimeters in the iodine/argon case. As a consequence, the position of the cathode wire close to the entrance window becomes a critical parameter for optimizing the detection efficiency.
- 19 August 2025
- Published by IOP Publishing in Measurement Science and Technology
- Vol. 36 (9)
Open AccessOptimized VUV-photon detection with acetone/CaF2 proportional counters for use in inverse photoemission
The detection of vacuum-ultraviolet photons in inverse-photoemission experiments is usually carried out with gas-filled counting tubes. Iodine/argon gas fillings have been used for Geiger-Müller-type photon detection. Later, the gas filling was replaced by acetone to increase stability and the operation was changed to proportional mode. While doing this, the counting tube geometry was not necessarily changed. We carried out a systematic study to understand the photon-detection process in acetone-filled counting tubes and to optimize the geometry accordingly. In the range of optimal gas pressures, we found that the photon mean free path in acetone is in the order of a few millimeters instead of a few centimeters in the iodine/argon case. As a consequence, the position of the cathode wire close to the entrance window becomes a critical parameter for optimizing the detection efficiency.
- 1 March 2025
- Published by AIP Publishing in Review of Scientific Instruments
- Vol. 96 (3)
VUV polarimeter for inverse photoemission
In angle-resolved photoelectron spectroscopy (ARPES) experiments, the use of polarized light for excitation provides access to the orbital symmetries of the electronic states under investigation. In angle-resolved inverse photoemission (IPE), the equivalent approach is the polarization analysis of the emitted light. So far, this light-polarization analysis has been neglected for intensity reasons due to the much lower cross section of the transitions in IPE compared with ARPES and the lack of suitable polarizers in the vacuum ultraviolet (VUV) spectral range. In this paper, we present the first VUV polarimeter for IPE. A mirror with a polarizing coating of high reflectivity in Brewster-angle geometry is used. An easy-to-use attachment to established photon detectors with high reflectivity and polarization power is presented and tested. We performed IPE measurements of the well-studied L-gap surface state of Cu(111) with separate detection of p- and s-polarized light. The data show strongly enhanced photon intensity for p polarization compared with the intensity for s polarization. Our results are in accordance with the polarization-dependent ARPES measurements of the occupied part of the surface state.
- 1 March 2025
- Published by AIP Publishing in Review of Scientific Instruments
- Vol. 96 (3)
VUV polarimeter for inverse photoemission
In angle-resolved photoelectron spectroscopy (ARPES) experiments, the use of polarized light for excitation provides access to the orbital symmetries of the electronic states under investigation. In angle-resolved inverse photoemission (IPE), the equivalent approach is the polarization analysis of the emitted light. So far, this light-polarization analysis has been neglected for intensity reasons due to the much lower cross section of the transitions in IPE compared with ARPES and the lack of suitable polarizers in the vacuum ultraviolet (VUV) spectral range. In this paper, we present the first VUV polarimeter for IPE. A mirror with a polarizing coating of high reflectivity in Brewster-angle geometry is used. An easy-to-use attachment to established photon detectors with high reflectivity and polarization power is presented and tested. We performed IPE measurements of the well-studied L-gap surface state of Cu(111) with separate detection of p- and s-polarized light. The data show strongly enhanced photon intensity for p polarization compared with the intensity for s polarization. Our results are in accordance with the polarization-dependent ARPES measurements of the occupied part of the surface state.
- Open Access
- 7 February 2025
- Published by American Physical Society (APS) in Physical Review B
- Vol. 111 (7)
Unoccupied electronic states of (100): An angle-resolved inverse-photoemission studyWe present an experimental study that offers first insights into the unoccupied electronic states of a pristine ( 2 × 2 ) R 45 ∘ reconstructed Fe 3 O 4 (100) surface. We initially demonstrate the successful sample preparation by analyzing the surface periodicity and chemical composition by low-energy electron diffraction and Auger electron spectroscopy, respectively. Using angle-resolved inverse photoemission, we study the unoccupied electronic states. We observe three nondispersive emissions, one dominant feature around 2 eV above the Fermi level and two additional ones at higher energies. For the low-lying triple-split feature, we propose two possible interpretations based on former theoretical studies. We either ascribe it to 3 d -related bandgroups originating from tetrahedrally and octahedrally coordinated bulk iron atoms or attribute it to a mixture of 3 d states originating from octahedrally coordinated iron atoms within the bulk and the reconstructed surface layer. The high-lying features are ascribed to bulk bands based on the experimentally observed characteristics.
- 7 February 2025
- Published by American Physical Society (APS) in Physical Review B
- Vol. 111 (7)
Open AccessUnoccupied electronic states of (100): An angle-resolved inverse-photoemission studyWe present an experimental study that offers first insights into the unoccupied electronic states of a pristine ( 2 × 2 ) R 45 ∘ reconstructed Fe 3 O 4 (100) surface. We initially demonstrate the successful sample preparation by analyzing the surface periodicity and chemical composition by low-energy electron diffraction and Auger electron spectroscopy, respectively. Using angle-resolved inverse photoemission, we study the unoccupied electronic states. We observe three nondispersive emissions, one dominant feature around 2 eV above the Fermi level and two additional ones at higher energies. For the low-lying triple-split feature, we propose two possible interpretations based on former theoretical studies. We either ascribe it to 3 d -related bandgroups originating from tetrahedrally and octahedrally coordinated bulk iron atoms or attribute it to a mixture of 3 d states originating from octahedrally coordinated iron atoms within the bulk and the reconstructed surface layer. The high-lying features are ascribed to bulk bands based on the experimentally observed characteristics.
- Open Access
- 24 June 2024
- Published by American Physical Society (APS) in Physical Review Research
- Vol. 6 (2) , 023314
-gap surface resonance at Pt(111): Influence of atomic structure, bands, and spin-orbit interactionPt(111) hosts a surface resonance with peculiar properties concerning energy vs momentum dispersion and spin texture. At variance with the free-electron-like behavior of the -gap Shockley-type surface states on the fcc(111) surfaces of Au, Ag, and Cu, it splits into several branches with distinct spin polarization around the center of the surface Brillouin zone . Theoretical predictions based on density-functional theory vary depending on the particular functionals used. To clarify this issue, we investigate the atomic structure of Pt(111) by low-energy electron diffraction and the unoccupied electronic structure by spin- and angle-resolved inverse photoemission. The experimental results are backed by theoretical studies using different functionals, which show that the characteristics of the surface band depend critically on the lattice constant. From the analysis of the energy-dependent low-energy electron diffraction intensities, we derive structural parameters of the Pt(111) surface relaxation with high accuracy. In addition, we give an unambiguous definition of the nonequivalent mirror-plane directions and at fcc(111) surfaces, which is consistent with band-structure calculations and inverse-photoemission data. Concerning the surface resonance at the bottom of the gap, we identified a delicate interplay of several contributions. Lattice constant, hybridization with bands, and the influence of spin-orbit interaction are critical ingredients for understanding the peculiar energy dispersion and spin character of the unoccupied surface resonance.- 24 June 2024
- Published by American Physical Society (APS) in Physical Review Research
- Vol. 6 (2) , 023314
Open Access-gap surface resonance at Pt(111): Influence of atomic structure, bands, and spin-orbit interactionPt(111) hosts a surface resonance with peculiar properties concerning energy vs momentum dispersion and spin texture. At variance with the free-electron-like behavior of the -gap Shockley-type surface states on the fcc(111) surfaces of Au, Ag, and Cu, it splits into several branches with distinct spin polarization around the center of the surface Brillouin zone . Theoretical predictions based on density-functional theory vary depending on the particular functionals used. To clarify this issue, we investigate the atomic structure of Pt(111) by low-energy electron diffraction and the unoccupied electronic structure by spin- and angle-resolved inverse photoemission. The experimental results are backed by theoretical studies using different functionals, which show that the characteristics of the surface band depend critically on the lattice constant. From the analysis of the energy-dependent low-energy electron diffraction intensities, we derive structural parameters of the Pt(111) surface relaxation with high accuracy. In addition, we give an unambiguous definition of the nonequivalent mirror-plane directions and at fcc(111) surfaces, which is consistent with band-structure calculations and inverse-photoemission data. Concerning the surface resonance at the bottom of the gap, we identified a delicate interplay of several contributions. Lattice constant, hybridization with bands, and the influence of spin-orbit interaction are critical ingredients for understanding the peculiar energy dispersion and spin character of the unoccupied surface resonance. - 9 April 2024
- Published by American Physical Society (APS) in Physical Review B
- Vol. 109 (16) , 165417
Spin-dependent hybridization of image-potential states and overlayer states: One monolayer of Tl on Ag(111)
We present a study of the unoccupied electronic states of one monolayer (ML) Tl epitaxially grown on Ag(111) in a moiré superstructure. This two-dimensional atomic-layer material is investigated by scanning tunneling microscopy/spectroscopy, spin-resolved inverse photoemission, and calculations based on density functional theory. The unoccupied band structure exhibits characteristic spin-dependent hybridization between overlayer states influenced by the substrate. Most of the experimentally observed bands, their behavior, and their Rashba-type spin dependence can be qualitatively described by a simple model for a Tl/Ag bilayer. A more realistic superstructure model reflecting the moiré structure provides deeper insight into the hybridization mechanisms for states of different orbital composition, further elucidated by calculations of the charge densities. Experimentally, measurements as well as the analysis of spin-dependent spectral intensities allow us to distinguish different orbital contributions in the respective spin-up and spin-down components leading to hybridization gaps with spin-dependent size. Most interestingly, spin-dependent hybridization with overlayer states was discovered for an image-potential-induced surface band, which is mainly located in front of the sample surface.- 9 April 2024
- Published by American Physical Society (APS) in Physical Review B
- Vol. 109 (16) , 165417
Spin-dependent hybridization of image-potential states and overlayer states: One monolayer of Tl on Ag(111)
We present a study of the unoccupied electronic states of one monolayer (ML) Tl epitaxially grown on Ag(111) in a moiré superstructure. This two-dimensional atomic-layer material is investigated by scanning tunneling microscopy/spectroscopy, spin-resolved inverse photoemission, and calculations based on density functional theory. The unoccupied band structure exhibits characteristic spin-dependent hybridization between overlayer states influenced by the substrate. Most of the experimentally observed bands, their behavior, and their Rashba-type spin dependence can be qualitatively described by a simple model for a Tl/Ag bilayer. A more realistic superstructure model reflecting the moiré structure provides deeper insight into the hybridization mechanisms for states of different orbital composition, further elucidated by calculations of the charge densities. Experimentally, measurements as well as the analysis of spin-dependent spectral intensities allow us to distinguish different orbital contributions in the respective spin-up and spin-down components leading to hybridization gaps with spin-dependent size. Most interestingly, spin-dependent hybridization with overlayer states was discovered for an image-potential-induced surface band, which is mainly located in front of the sample surface.- Open Access
- 1 October 2023
- Published by IOP Publishing in New Journal of Physics
- Vol. 25 (10) , 103037
Interplay of spin–orbit and exchange interaction in a ferromagnet/heavy-metal hybrid system: Ni on W(110)
In a combined experimental and theoretical study, we investigate the interplay of spin–orbit interaction (SOI) and exchange interaction (XI) in the electronic structure of ultrathin Ni films on W(110). Using spin- and angle-resolved inverse photoemission, we observe that the size of the spin splitting of Ni-related exchange-split states differs for opposite magnetization directions. A quenched spin splitting for one of the magnetization directions reveals a contribution of SOI on an equal footing with XI. Using density-functional theory calculations, we explore the underlying mechanisms responsible for the experimentally observed coupling of SOI and XI. We find that a hybridization between adsorbate and substrate states, along with a high probability density of the respective states at the heavy W nuclei, cause the strong influence of SOI on the Ni-related exchange-split states.
- 1 October 2023
- Published by IOP Publishing in New Journal of Physics
- Vol. 25 (10) , 103037
Open AccessInterplay of spin–orbit and exchange interaction in a ferromagnet/heavy-metal hybrid system: Ni on W(110)
In a combined experimental and theoretical study, we investigate the interplay of spin–orbit interaction (SOI) and exchange interaction (XI) in the electronic structure of ultrathin Ni films on W(110). Using spin- and angle-resolved inverse photoemission, we observe that the size of the spin splitting of Ni-related exchange-split states differs for opposite magnetization directions. A quenched spin splitting for one of the magnetization directions reveals a contribution of SOI on an equal footing with XI. Using density-functional theory calculations, we explore the underlying mechanisms responsible for the experimentally observed coupling of SOI and XI. We find that a hybridization between adsorbate and substrate states, along with a high probability density of the respective states at the heavy W nuclei, cause the strong influence of SOI on the Ni-related exchange-split states.
- 23 May 2023
- Published by American Physical Society (APS) in Physical Review B
- Vol. 107 (20) , 205144
Structural and electronic properties of Tl films on Ag(111): From surface alloy to moiré superstructureWe present a detailed study of the growth behavior and the electronic properties of thin Tl films epitaxially grown on Ag(111). We combine experimental results obtained by Auger electron spectroscopy, low-energy electron diffraction, scanning tunneling microscopy, scanning tunneling spectroscopy (STS), and inverse photoemission (IPE). The electronic properties identified by STS and IPE are substantiated via density functional theory (DFT) calculations. For a Tl coverage of 0.33 atomic layers (AL), our experimental results show the formation of small patches with a reconstruction. With STS and IPE, we observe two dominant empty-state electronic features at and 3.5 eV, which are attributed to downward dispersing -derived states and to states with orbital symmetry, respectively. On the basis of band structure and charge distribution calculations, we discuss the variation of the binding energies of the respective electronic features observed by STS and IPE. Above 0.5 AL, a moiré superstructure evolves due to the rather large lattice mismatch between the Tl adlayer and Ag(111) which exhibits a sharp spectroscopic feature at around eV in STS and IPE. The comparison with DFT calculations suggests that it originates from a predominantly -like surface state. For even larger film thicknesses up to 4 AL, we find a rotation of the Tl layer with respect to the Ag(111) substrate of .- 23 May 2023
- Published by American Physical Society (APS) in Physical Review B
- Vol. 107 (20) , 205144
Structural and electronic properties of Tl films on Ag(111): From surface alloy to moiré superstructureWe present a detailed study of the growth behavior and the electronic properties of thin Tl films epitaxially grown on Ag(111). We combine experimental results obtained by Auger electron spectroscopy, low-energy electron diffraction, scanning tunneling microscopy, scanning tunneling spectroscopy (STS), and inverse photoemission (IPE). The electronic properties identified by STS and IPE are substantiated via density functional theory (DFT) calculations. For a Tl coverage of 0.33 atomic layers (AL), our experimental results show the formation of small patches with a reconstruction. With STS and IPE, we observe two dominant empty-state electronic features at and 3.5 eV, which are attributed to downward dispersing -derived states and to states with orbital symmetry, respectively. On the basis of band structure and charge distribution calculations, we discuss the variation of the binding energies of the respective electronic features observed by STS and IPE. Above 0.5 AL, a moiré superstructure evolves due to the rather large lattice mismatch between the Tl adlayer and Ag(111) which exhibits a sharp spectroscopic feature at around eV in STS and IPE. The comparison with DFT calculations suggests that it originates from a predominantly -like surface state. For even larger film thicknesses up to 4 AL, we find a rotation of the Tl layer with respect to the Ag(111) substrate of .- 26 April 2023
- Published by American Physical Society (APS) in Physical Review B
- Vol. 107 (16) , 165420
Surface electronic structure of Re(0001): A spin-resolved photoemission study
The surface electronic structure of Re(0001) has been investigated in a combined experimental and theoretical study. Spin- and angle-resolved photoemission was employed to unravel the spin-dependent dispersion of electronic states along the and directions. The results are compared with band-structure calculations based on density-functional theory. Additional calculations include transitions into final states by taking into account the corresponding matrix elements. Recently, Shockley- and Tamm-type surface states close to were identified, which were found to be mixed by spin-orbit coupling. Here, we determined the Rashba parameter of the surface state around to 0.32 and along and , respectively. Furthermore, we extend our analysis to a wider range revealing a multitude of electronic states along both high-symmetry directions. In particular, Rashba-type spin splittings are observed around the high-symmetry and points. At variance with theoretical predictions for a perfect hcp(0001) surface, we do not find any out-of-plane spin polarization. This is caused by monatomic steps of a real Re(0001) surface with alternating terminations, leading on average to an effective sixfold surface symmetry and vanishing net out-of-plane spin polarization.- 26 April 2023
- Published by American Physical Society (APS) in Physical Review B
- Vol. 107 (16) , 165420
Surface electronic structure of Re(0001): A spin-resolved photoemission study
The surface electronic structure of Re(0001) has been investigated in a combined experimental and theoretical study. Spin- and angle-resolved photoemission was employed to unravel the spin-dependent dispersion of electronic states along the and directions. The results are compared with band-structure calculations based on density-functional theory. Additional calculations include transitions into final states by taking into account the corresponding matrix elements. Recently, Shockley- and Tamm-type surface states close to were identified, which were found to be mixed by spin-orbit coupling. Here, we determined the Rashba parameter of the surface state around to 0.32 and along and , respectively. Furthermore, we extend our analysis to a wider range revealing a multitude of electronic states along both high-symmetry directions. In particular, Rashba-type spin splittings are observed around the high-symmetry and points. At variance with theoretical predictions for a perfect hcp(0001) surface, we do not find any out-of-plane spin polarization. This is caused by monatomic steps of a real Re(0001) surface with alternating terminations, leading on average to an effective sixfold surface symmetry and vanishing net out-of-plane spin polarization.