Nanomaterials Design: Researchers use NWChem to design and optimize the properties of new nanomaterials, such as carbon nanotubes and quantum dots. Drug Delivery Systems: The software helps in the development of nanocarriers for targeted drug delivery, improving the efficacy of treatments. Energy Storage: NWChem aids in the design of nanostructured materials for batteries and supercapacitors, enhancing energy storage technologies. Catalysis: The software is used to study the catalytic properties of nanoparticles, leading to more efficient industrial processes.