Graphene-related nanomaterials: tuning properties by functionalization
In this review, we discuss the most recent progress on graphene-related nanomaterials,
including doped graphene and derived graphene nanoribbons, graphene oxide, graphane …
including doped graphene and derived graphene nanoribbons, graphene oxide, graphane …
Prospects of spintronics based on 2D materials
Spintronics holds the promise for future information technologies. Devices based on
manipulation of spin are most likely to replace the current silicon complementary metal …
manipulation of spin are most likely to replace the current silicon complementary metal …
Magnetic properties of single transition-metal atom absorbed graphdiyne and graphyne sheet from DFT+ U calculations
The electronic and magnetic properties of single 3d transition-metal (TM) atom (V, Cr, Mn,
Fe, Co, and Ni) adsorbed graphdiyne (GDY) and graphyne (GY) are systematically studied …
Fe, Co, and Ni) adsorbed graphdiyne (GDY) and graphyne (GY) are systematically studied …
Tuning the structural, electronic, and magnetic properties of germanene by the adsorption of 3d transition metal atoms
TP Kaloni - The Journal of Physical Chemistry C, 2014 - ACS Publications
The structural, electronic, and magnetic properties of 3d transition metal (TM) atoms (Sc, Ti,
V, Cr, Mn, Fe, Co, Ni, Cu, and Zn) adsorbed germanene are addressed using density …
V, Cr, Mn, Fe, Co, Ni, Cu, and Zn) adsorbed germanene are addressed using density …
Electronic and magnetic properties of 4d series transition metal substituted graphene: a first-principles study
We implement a theoretical study of the geometry parameters, binding energies, electronic
and magnetic properties of 4d series transition metals substituted graphene. Based on a …
and magnetic properties of 4d series transition metals substituted graphene. Based on a …
Tuning magnetism at the two-dimensional limit: A theoretical perspective
The discovery of two-dimensional (2D) magnetic materials provides an ideal testbed for
manipulating the magnetic properties at the atomically thin and 2D limit. This review gives …
manipulating the magnetic properties at the atomically thin and 2D limit. This review gives …
In situ do**-enabled metal and nonmetal codo** in graphene quantum dots: Synthesis and application for contaminant sensing
Fluorescent graphene quantum dots (GQDs) prepared from low-cost and sustainable
precursors are highly desirable for various applications, including luminescence-based …
precursors are highly desirable for various applications, including luminescence-based …
Ga and Ge-doped graphene structures: A DFT study of sensor applications for methanol
Density functional theory calculations have been carried out to investigate the adsorption of
methanol on the surface of Ga and Ge-doped graphene clusters and in order to explore the …
methanol on the surface of Ga and Ge-doped graphene clusters and in order to explore the …
Palladium-functionalized graphene for hydrogen sensing performance: theoretical studies
The adsorption characteristics of H2 molecules on the surface of Pd-doped and Pd-
decorated graphene (G) have been investigated using density functional theory (DFT) …
decorated graphene (G) have been investigated using density functional theory (DFT) …
Electronic structure of the substitutional vacancy in graphene: density-functional and Green's function studies
We study the electronic structure of graphene with a single substitutional vacancy using a
combination of the density-functional, tight-binding and impurity Green's function …
combination of the density-functional, tight-binding and impurity Green's function …