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 …

Quantum electronics has significantly evolved over the last decades. Where initially the clear
focus was on light–matter interactions, nowadays approaches based on the electron's wave …

The central question in the field of two-dimensional (2D) materials is how a material
behaves when it is patterned at nanometer scale with different edge geometries. Due to the …

For the pristine phosphorene nanoribbons (PNRs) with edge states, there exist two
categories of edge bands near the Fermi energy (EF), ie, the shuttle-shaped twofold …

We put forward a gauge-invariant theoretical framework for studying time-resolved
thermoelectric transport in an arbitrary multiterminal electronic quantum system described by …

The edge states of two-dimensional time-reversal topological insulators support a perfect
helical conductance on wide ribbons due to the absence of backscattering. Here, we study …

In quantum transport calculations, the proper handling of incoming and outgoing modes for
retarded Green's functions is achieved via the lead self-energies. Computationally efficient …

We study the equilibrium and nonequilibrium electronic transport properties of multiprobe
topological systems using a combination of the Landauer-Büttiker approach and …

In this work we develop EPOCH (equilibrium propagator by orthogonal polynomial chain), a
computationally efficient method to calculate the time-dependent equilibrium Green's …

We propose a divide-and-conquer algorithm to find recursively the scattering matrix of
general tight-binding structures. The scattering matrix allows a direct calculation of transport …