[HTML][HTML] Dyson-orbital concepts for description of electrons in molecules
JV Ortiz - The Journal of chemical physics, 2020 - pubs.aip.org
Dyson orbitals, their electron-binding energies, and probability factors provide descriptions
of electrons in molecules that are experimentally verifiable and that generalize qualitatively …
of electrons in molecules that are experimentally verifiable and that generalize qualitatively …
Efficient orbital imaging based on ultrafast momentum microscopy and sparsity-driven phase retrieval
GSM Jansen, M Keunecke, M Düvel… - New Journal of …, 2020 - iopscience.iop.org
We present energy-resolved photoelectron momentum maps for orbital tomography that
have been collected with a novel and efficient time-of-flight momentum microscopy setup …
have been collected with a novel and efficient time-of-flight momentum microscopy setup …
[HTML][HTML] Combined orbital tomography study of multi-configurational molecular adsorbate systems
Molecular reactivity is determined by the energy levels and spatial extent of the frontier
orbitals. Orbital tomography based on angle-resolved photoelectron spectroscopy is an …
orbitals. Orbital tomography based on angle-resolved photoelectron spectroscopy is an …
[HTML][HTML] kMap. py: A Python program for simulation and data analysis in photoemission tomography
Ultra-violet photoemission spectroscopy is a widely-used experimental technique to
investigate the valence electronic structure of surfaces and interfaces. When detecting the …
investigate the valence electronic structure of surfaces and interfaces. When detecting the …
[HTML][HTML] Ultrafast orbital tomography of a pentacene film using time-resolved momentum microscopy at a FEL
K Baumgärtner, M Reuner, C Metzger… - Nature …, 2022 - nature.com
Time-resolved momentum microscopy provides insight into the ultrafast interplay between
structural and electronic dynamics. Here we extend orbital tomography into the time domain …
structural and electronic dynamics. Here we extend orbital tomography into the time domain …
A minimalist approach to 3D photoemission orbital tomography: algorithms and data requirements
Photoemission orbital tomography provides direct access from laboratory measurements to
the real-space molecular orbitals of well-ordered organic semiconductor layers. Specifically …
the real-space molecular orbitals of well-ordered organic semiconductor layers. Specifically …
Photoemission orbital tomography based on tight-binding approach: Method and application to -conjugated molecules
M Nozaki, T Konishi - Physical Review B, 2024 - APS
Conventional photoemission orbital tomography based on the Fourier iterative method
enables us to extract a projected two-dimensional (2D) molecular orbital from a 2D …
enables us to extract a projected two-dimensional (2D) molecular orbital from a 2D …
[HTML][HTML] Molecular anchoring stabilizes low valence Ni (i) TPP on copper against thermally induced chemical changes
HM Sturmeit, I Cojocariu, M Jugovac… - Journal of Materials …, 2020 - pubs.rsc.org
Many applications of molecular layers deposited on metal surfaces, ranging from single-
atom catalysis to on-surface magnetochemistry and biosensing, rely on the use of thermal …
atom catalysis to on-surface magnetochemistry and biosensing, rely on the use of thermal …
Polarization and phase textures in lattice plasmon condensates
Polarization textures of light may reflect fundamental phenomena, such as topological
defects, and can be utilized in engineering light beams. They have been observed, for …
defects, and can be utilized in engineering light beams. They have been observed, for …
Can photoemission tomography be useful for small, strongly-interacting adsorbate systems?
L Egger, B Kollmann, P Hurdax, D Lüftner… - New Journal of …, 2019 - iopscience.iop.org
Molecular orbital tomography, also termed photoemission tomography, which considers the
final state as a simple plane wave, has been very successful in describing the photoemisson …
final state as a simple plane wave, has been very successful in describing the photoemisson …