activity
19982026
most citedTime-dependent quantum transport: A practical scheme using density functional theory

315 citations · 3.8k across the 115 of their papers we have counts for

collaborators
Showing 2021Show all

8 papers · 1 filter

cond-mat.other2021★ 27 cited

Time-linear scaling NEGF methods for real-time simulations of interacting electrons and bosons. II. Dynamics of polarons and doublons

Yaroslav Pavlyukh, Enrico Perfetto, Daniel Karlsson +2

Nonequilibrium dynamics of the open chain Holstein-Hubbard model is studied using the linear time-scaling GKBA+ODE scheme developed in the preceeding paper. We focus on the set of…

cond-mat.str-el2021★ 47 cited

Time-linear scaling NEGF methods for real-time simulations of interacting electrons and bosons. I. Formalism

Yaroslav Pavlyukh, Enrico Perfetto, Daniel Karlsson +2

Simulations of interacting electrons and bosons out of equilibrium, starting from first principles and aiming at realistic multiscale scenarios, is a grand theoretical challenge. H…

cond-mat.mes-hall2021★ 69 cited

Real-time GW: Toward an ab initio description of the ultrafast carrier and exciton dynamics in two-dimensional materials

E. Perfetto, Y. Pavlyukh, G. Stefanucci

We demonstrate the feasibility of the time-linear scaling formulation of the method [Phys. Rev. Lett. {\bf 124}, 076601 (2020)] for {\it ab initio} simulations of optically dr…

cond-mat.mtrl-sci2021★ 6 cited

Coherence and de-coherence in the Time-Resolved ARPES of realistic materials: an ab-initio perspective

Andrea Marini, Enrico Perfetto, Gianluca Stefanucci

Coherence and de-coherence are the most fundamental steps that follow the initial photo-excitation occurring in typical Pump&Probe experiments. Indeed, the initial external laser p…

cond-mat.mes-hall2021★ 15 cited

Thermoelectric transport within density functional theory

Nahual Sobrino, Florian Eich, Gianluca Stefanucci +2

A new formalism to describe steady-state electronic and thermal transport in the framework of density functional theory is presented. A one-to-one correspondence is proven between…

cond-mat.other2021★ 19 cited

From carriers and virtual excitons to exciton populations: Insights into time-resolved ARPES spectra from an exactly solvable model

G. Stefanucci, E. Perfetto

We calculate the {\em exact} time-resolved ARPES spectrum of a two-band model semiconductor driven out of equilibrium by resonant and nonresonant laser pulses, highlighting the eff…