2D Materials, Type-II band alignment, MoS2/GaN vdWH, biaxial strain, Optical properties
2D material, Rare earth metal, Electronic structure, Magnetic properties, First-principles calculations
Perovskite oxides, Photocatalyst, Machine learning, Materials discovery, Density Functional Theory
adsorption energy, machine learning, catalytic reactions, crystal plane
Arsenic phosphorus, Alkali metal, Gas sensing properties, First-principles calculations
WS2 nanoflower, Gas sensor, machine Learning
electromagnetic wave absorption, Carbon aerogel, First-principle calculations, Thermal insulation
Cobalt/carbon aerogels, Impedance matching, Interfacial polarization, Electromagnetic wave absorption
First principles method, Black phosphorene, Electronic structures, Gas sensing properties
Electron localization, Magnetocrystalline anisotropy, Electromagnetic wave absorption, Ferrite.
