Complex multiscale dynamics are inherent to materials, where the interconnection across molecular, microscopic, and macroscopic levels is key to understanding their fundamental mechanisms. A prime ...
Configurational entropy quantifies the number of accessible molecular arrangements within a system and is a critical parameter in understanding thermodynamic properties, binding affinities and ...
Electro- and photocatalytic materials are central to enabling sustainable energy conversion processes such as water splitting, CO2 reduction, oxygen ...