The application discloses an Al-doped two-dimensional MnO2 adsorption structure for SO2 immobilized adsorption and application thereof. The Al-doped two-dimensional MnO2 adsorption structure for SO2 immobilized adsorption comprises a two-dimensional MnO2
monolayer as a substrate, and Al modified atoms on H sites on the surface of the substrate, wherein the
doping concentration of the Al modified atoms is 2% to 4%. A stable Al-O
interaction interface is formed between the Al modified atoms and O atoms in SO2 molecules, so that a strong
chemical adsorption interface dominated by ionic bond interaction is formed between SO2 and the adsorption structure; in a preferred configuration, the
adsorption energy of the adsorption structure for SO2 is -2.154 eV, the interface charge transfer amount is -0.49 e, and the Al-O interaction distance is 1.737 Å. The adsorption structure can be used for irreversible capture, enrichment and immobilized adsorption of SO2, and
industrial waste gas desulfurization and capture of
toxic gas containing
sulfur.