Study of adsorption characteristics of two-dimensional boron

Бесплатный доступ

The article examines the adsorption properties of two-dimensional boron, paying special attention to its unique structure and electronic configuration. 2D boron exhibits a more complex arrangement of atoms, providing a variety of sites for atom adsorption. Its high surface area to volume ratio makes it attractive for applications requiring efficient binding of molecules, such as gas storage and separation. In this work, the mechanism of adsorption of the oxygen atom on five different adsorption centers of planar boron was studied; the MNDO calculation scheme was used for calculations.

Метод mndo

Короткий адрес: https://sciup.org/170203562

IDR: 170203562   |   DOI: 10.24412/2500-1000-2024-3-4-211-214

Статья научная