2 papers
cond-mat.mtrl-sci2026
Accurate Nanoscale Mapping of Electric Fields across Random Grain Boundaries in Polycrystalline Oxides Using Precession-Assisted 4D-STEM
Sangjun Kang, Hyeyoung Cho, Maximilian Töllner +12
Space charge layers (SCLs) at grain boundaries play a crucial role in modulating local electric fields and influencing the functional properties of materials, such as oxygen vacanc…
physics.chem-ph2025
Effective Core Potentials for calculations of continuum spectra of molecules using the molecular R-matrix method
Zdenek Masin, Jakub Benda, Martin Crhan +4
Implementation of Effective Core Potentials (ECPs) into the molecular scattering suite UKRmol+ is presented together with a set of calculations for a range of targets relevant for…