NANOSYSTEMS: PHYSICS, CHEMISTRY, MATHEMATICS, 2018, 9 (3), P. 330–334
Double-layered boron. The adsorption of gas-phase atom
E.V. Boroznina – Volgograd State University, University Ave. 100, Volgograd 400062, Russia; boroznina.evgeniya@volsu.ru
O. A. Kakorina – Volgograd State University, University Ave. 100, Volgograd 400062, Russia; davletova.olesya@volsu.ru
M. B. Belonenko – Volgograd State University, University Ave. 100, Volgograd 400062, Russia
In this paper, we have considered hexagonal double-layered boron and its adsorption properties in particular. The main adsorption characteristics have been elucidated by using the semi-empirical quantum-chemical scheme MNDO. We have investigated both external adsorption and internal infiltration of atoms (H, O, F, Cl) between boron monolayers.
Keywords: Boron sheet, double-layered materials, semi-empirical research, atomic adsorption.
DOI 10.17586/2220-8054-2018-9-3-330-334
