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physics.chem-ph2025

Enhanced sensitivity to variations of fundamental constants in highly charged molecules from analytic perturbation theory

Carsten Zülch, Carsten Zülch, Konstantin Gaul +1

Quasi-forbidden electronic transitions in atoms and vibronic transitions between quasi-degenerate states in molecules serve as powerful probes of hypothetical temporal variations o…

physics.chem-ph2025

Relativistic and quantum electrodynamics effects on NMR shielding tensors of Tl ( = H, F, Cl, Br, I, At) molecules

Karol Kozioł, I. Agustín Aucar, Konstantin Gaul +2

Results of relativistic calculations of nuclear magnetic resonance shielding tensors () for the thallium monocation (Tl), thallium hydride (TlH) and thallium halides (TlF,…

physics.chem-ph2024

Towards detection of molecular parity violation via chiral co-sensing: the H/P model system

Erik Van Dyke, James Eills, Kirill Sheberstov +10

Fundamental weak interactions have been shown to violate parity in both nuclear and atomic systems. However, observation of parity violation in a molecular system has proven an elu…

physics.chem-ph2024

Quantum electrodynamic corrections for molecules: Vacuum polarisation and electron self energy in a two-component relativistic framework

Kjell Janke, Andrés Emilio Wedenig, Peter Schwerdtfeger +2

Vacuum polarisation (VP) and electron self energy (SE) are implemented and evaluated as quantum electrodynamic (QED) corrections in a (quasi-relativistic) two-component zeroth orde…

physics.chem-ph2024

Stopping mass-selected alkaline-earth metal monofluoride beams of high energy via formation of unusually stable anions

Konstantin Gaul, Ronald F. Garcia Ruiz, Robert Berger

Direct laser-coolability and a comparatively simple electronic structure render alkaline-earth metal monofluoride molecules versatile laboratories for precision tests of fundamenta…