2 papers
cond-mat.mtrl-sci2026
SoLiD26: A First Principles Solid-Liquid Interface Dataset for Machine-learned Interatomic Potentials
Jonas Busk, Emil J. P. Frost, Yogeshwaran Krishnan +7
Machine-learned interatomic potentials (MLIPs) for solid-liquid interfaces in advanced materials applications, e.g., electrochemistry, catalysis and corrosion, require training dat…
cond-mat.mtrl-sci2020
Structural and chemical mechanisms governing stability of inorganic Janus nanotubes
Felix Tim Bölle, August E. G. Mikkelsen, Kristian S. Thygesen +2
One-dimensional inorganic nanotubes hold promise for technological applications due to their distinct physical/chemical properties, but so far advancements have been hampered by di…