Emergence of π-magnetism in open-shell nanographenes has been theoretically predicted
decades ago but their experimental characterization was elusive due to the strong chemical …

In this paper we present a paradigmatic tight-binding model for single-layer as well as
multilayered semiconducting MoS 2 and similar transition metal dichalcogenides. We show …

Graphene is the strongest material ever studied and can be an efficient substitute for silicon.
This six-volume handbook focuses on fabrication methods, nanostructure and atomic …

In this review we discuss the multifaceted problem of spin transport in hydrogenated
graphene from a theoretical perspective. The current experimental findings suggest that …

We propose an extensive report on the simulation of electronic transport in two-dimensional
graphene in presence of structural defects. Amongst the large variety of such defects in sp 2 …

Using both first-principles techniques and a real-space Kubo-Greenwood approach,
electronic and transport properties of nitrogen-doped graphene with a single sublattice …

Spin-orbit coupling (SOC) can provide essential tools to manipulate electron spins in two-
dimensional materials like graphene, which is of great interest for both fundamental physics …

The observation of intrinsic magnetic order in graphene and graphene-based materials
relies on the formation of magnetic moments and a sufficiently strong mutual interaction …

Using density-functional calculations, we study the effect of sp 3-type defects created by
different covalent functionalizations on the electronic and magnetic properties of graphene …

Spin-dependent features in the conductivity of graphene, chemically modified by a random
distribution of hydrogen adatoms, are explored theoretically. The spin effects are taken into …