When monolayers of two-dimensional (2D) materials are stacked into van der Waals
structures, interlayer electronic coupling can introduce entirely new properties, as …

Abstract yambo is an open source project aimed at studying excited state properties of
condensed matter systems from first principles using many-body methods. As input, yambo …

Ultraflatbands in twisted bilayers of two-dimensional materials have the potential to host
strong correlations, including the Mott-insulating phase at half-filling of the band. Using first …

Transition-metal dichalcogenides (TMDs) are promising for two-dimensional (2D)
semiconducting devices and novel phenomena. For 2D applications, their work function …

In two-dimensional chiral metal-halide perovskites, chiral organic spacers endow structural
and optical chirality to the metal-halide sublattice, enabling exquisite control of light, charge …

We present a systematic study of the variables affecting the electronic and optical properties
of two-dimensional (2D) crystals within ab initio GW and GW plus Bethe-Salpeter equation …

The bottom-up approach to synthesize graphene nanoribbons strives not only to introduce a
band gap into the electronic structure of graphene but also to accurately tune its value by …

We present the GW 100 set. GW 100 is a benchmark set of the ionization potentials and
electron affinities of 100 molecules computed with the GW method using three independent …

SnSe and GeSe are layered compound semiconductors that can be exfoliated to form two-
dimensional materials. In this work, we use predictive calculations based on density …

Zigzag edges of graphene nanostructures host localized electronic states that are predicted
to be spin-polarized. However, these edge states are highly susceptible to edge roughness …