CuI/InSe, photocatalytic property, exciton binding energy, carrier mobility
TiAl3, Nb-doping, electronic structure, Elastic properties, Anisotropy
Ni3Sr, Ni3Ba, Electronic Structure, Elastic property, Thermodynamic property
Intermetallic Compounds, First-principles, Thermodynamic Properties, Elastic Properties, Electronic Structure
Ni3Ti intermetallics, Electronic structure, Elastic property, Doping
Two-dimensional heterostructure, First-principles calculation, Photocatalysis, Electronic structure