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List of works by Gang Lu

Auger Processes and Excited State Dynamics in WS<sub>2</sub>/Graphene Heterostructures: A First-Principles Perspective

scientific article published in 2022

Band Alignment in Two-Dimensional Halide Perovskite Heterostructures: Type I or Type II?

scientific article published on 30 March 2020

Efficient oxygen reduction catalysis by subnanometer Pt alloy nanowires.

scientific article published on 24 February 2017

First-order nonadiabatic couplings in extended systems by time-dependent density functional theory

scientific article published on 01 December 2018

Intramolecular Band Alignment and Spin-Orbit Coupling in Two-Dimensional Halide Perovskites

scientific article published on 12 August 2020

Linear-Response Time-Dependent Density Functional Theory with Stochastic Range-Separated Hybrids

scientific article published on 14 January 2020

Modeling Auger Processes with Nonadiabatic Molecular Dynamics

scientific article published on 15 December 2020

Nonbonding Metal–Metal Interaction in Metal–Nitrogen–Carbon Single-Atom Catalysts Boosts CO Electroreduction

scientific article published in 2024

Precise tuning in platinum-nickel/nickel sulfide interface nanowires for synergistic hydrogen evolution catalysis

scientific article published on 27 February 2017

Reducing Anomalous Hysteresis in Perovskite Solar Cells by Suppressing the Interfacial Ferroelectric Order

scientific article published on 02 March 2020

Self-Healing of Photocurrent Degradation in Perovskite Solar Cells: The Role of Defect-Trapped Excitons

scientific article published on 04 December 2019

Shedding light on moiré excitons: A first-principles perspective

scientific article published on 16 October 2020

Subspace formulation of time-dependent density functional theory for large-scale calculations.

scientific article published in August 2015

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