In recent years, predictive computational modeling has become a cornerstone for the study
of fundamental electronic, optical, and thermal properties in complex forms of condensed …

It has been recently shown that monolayers of transition metal dichalcogenides (TMDs) in
the 2H structural phase exhibit relatively large orbital Hall conductivity plateaus within their …

The nonlinear Hall effect has recently attracted significant interest due to its potential as a
promising spectral tool and for device applications. A theory of the nonlinear Hall effect on a …

TBPLaS is an open-source software package for the accurate simulation of physical systems
with arbitrary geometry and dimensionality utilizing the tight-binding (TB) theory. It has an …

We show that H-phase transition metal dichalcogenide (TMD) monolayers, such as MoS 2
and WSe 2, are orbital Hall insulators. They present very large orbital Hall conductivity …

We investigate a generalized multiorbital tight-binding model on a triangular lattice, a system
prevalent in a wide range of two-dimensional materials and particularly relevant for …

Hot electrons generated from the decay of localized surface plasmons in metallic
nanostructures have the potential to transform photocatalysis, photodetection, and other …

We present the first theoretical study of transport properties of Weyl semimetals with point
defects. Focusing on a class of time-reversal symmetric Weyl lattice models, we show that …

In this paper, we developed a basis-independent perturbative method for calculating the non-
linear optical response of arbitrary non-interacting tight-binding models. Our method is …

Recently, there has been significant interest in harnessing hot-carriers generated from the
decay of localized surface plasmons in metallic nanoparticles for applications in …