DOI: 10.1039/d6ra06008k ISSN: 2046-2069

Anharmonic and surface effects on thermodynamic properties of Ag, Al, and Cu nanostructures

Hua Xuan Dat, Nguyen Thi Thao, Ho Khac Hieu

Coupling SMM with a size- and shape-dependent bonding-energy model reveals how surface and anharmonic effects govern MSD, thermal expansion, heat capacity, and Debye temperature in Ag, Al, and Cu nanostructures.