keywords (CuO) n cluster (TiO 2 ) n cluster AG Adsorption and sensing BAND-GAP Chemistry Chemistry, Physical DENSITY-FUNCTIONAL THEORY DIOXIDE DISSOLVED-GAS ANALYSIS ELECTRONIC-STRUCTURE First-principles theory MAGNETIC-PROPERTIES Materials Science Materials Science, Coatings & Films MoTe 2 monolayer POWER TRANSFORMERS Physical Sciences Physics Physics, Applied Physics, Condensed Matter STABILITY Science & Technology TEMPERATURE Technology