Two-dimensional quantum dots have received a lot of attention in recent years due to their
fascinating properties and widespread applications in sensors, batteries, white light-emitting …

Triangulene and its higher homologues are a class of zigzag‐edged triangular graphene
molecules (ZTGMs) with high‐spin ground states. These open‐shell molecules are …

Triangulene-based nanostructures have been recently synthesized in great variety,
demonstrating exceptional physics and chemistry. Herein we investigate triangulene-based …

The electronic and optical properties of finite silicene, graphene, and arsenene
heterostructures are investigated using first principles calculations. The optoelectronic …

The electronic structure and optical properties of hexagonal armchair and zigzag-edged
graphene quantum dots (GQDs) are investigated within the framework of many-body …

The adsorption of hydrated heavy metals on graphene quantum dots is investigated using
the density functional theory. The considered heavy metals are Cd and Pb that are hexa …

We investigate the magnetic, electronic, and transport properties of chemically modified
Clar's goblets and laterally connected graphene quantum dots (GQDs) using density …

The electronic and adsorption properties of chemically modified square hexagonal boron
nitride quantum dots are investigated using density functional theory calculations. The free …

We present a theory of electronic properties of gated triangular graphene quantum dots with
zigzag edges as a function of size and carrier density. We focus on electronic correlations …

We have studied hydrogen-passivated amorphous carbon nanostructures with
semiempirical molecular orbital theory in order to provide an understanding of the factors …