The review generalizes information on methods for modification of graphene-based carbon
materials through creation of structural defects, introduction of substitutional impurities …

Polar surfaces of compound materials have been the subject of intense activity in the past.
Electrostatic arguments, based on a model of rigid charges, predict that they should have an …

We report a systematic computational study of the structural and optoelectronic properties of
unsaturated ZnO and ZnS nanoclusters with hexagonal prism structure, as a function of …

The magnetic property induced by the native defects in ZnS bulk, thin film, and quantum dots
are investigated comprehensively based on density functional theory within the generalized …

The electronic, magnetic and optical properties of Zn-doped monolayer SnS 2 have been
theoretically investigated with the density functional theory. Numerical results reveal that …

Here, we investigate the stabilities, band structures and optical properties of single-layer
hexagonal zinc chalcogenides (h-ZnX, X= S, Se, and Te) by performing first-principles …

Аннотация Обобщены сведения по способам модифицирования углеродных
материалов на основе графена—за счет создания структурных дефектов, путем …

First-principles calculations were employed to explore the electronic properties of SnSe
nanoribbons. Our results showed that a semiconductor–metal or metal–semiconductor …

Quite recently, the two-dimensional (2D) InSe nanosheet has become a hot material with
great promise for advanced functional nano-devices. In this work, for the first time, we …

Two-dimensional (2D) semiconductor gallium monochalcogenides GaX (X= S, Se) hold
great promise for future electronics and optics. In this paper, geometrical structures and …