Publications

2024

• Outstanding Properties of the Hydration Shell around β-d-Glucose: A Computational Study
• Local- and Intermediate-range Partial Structure Study of As–Se Glasses
• Lithium Ion Transport Environment by Molecular Vibrations in Ion-Conducting Glasses

2023

• Evolution of the hydrogen-bonded network in methanol-water mixtures upon cooling

2022

• Topological descriptors and Laplace spectra in simple hydrogen bonded systems
• On the Temperature- and Pressure-Dependent Structure of Liquid Phosphorus: A Reverse Monte Carlo Study
• Structural properties of chalcogenide glasses and the isocoordination rule: Disentangling effects from chemistry and network topology
• Relationship between atomic structure and excellent glass forming ability in Pd42.5Ni7.5Cu30P20 metallic glass
  
• Structural studies of 1H-containing liquids by polarized neutrons: Chemical environment and wavelength dependence of the incoherent background

2021

• Temperature-dependent structure of 1-propanol/water mixtures: X-ray diffraction experiments and computer simulations at low and high alcohol contents
• The influence of cations on the dipole moments of neighboring polar molecules
• Properties of Hydrogen-Bonded Networks in Ethanol–Water Liquid Mixtures as a Function of Temperature: Diffraction Experiments and Computer Simulations
• Hydrogen bonding and percolation in propan-2-ol – Water liquid mixtures: X-ray diffraction experiments and computer simulations
• Pressure-Dependent Structure of Methanol–Water Mixtures up to 1.2 GPa: Neutron Diffraction Experiments and Molecular Dynamics Simulations
• Detailed structural analysis of amorphous Pd40Cu40P20: Comparison with the metallic glass Pd40Ni40P20 from the viewpoint of glass forming ability
• Detailed investigations on short- and intermediate-range structures of Ge-Se glasses near the stiffness transition composition