most citedFirst-principles Nonadiabatic Dynamics of Molecules at Metal Surfaces with Vibrationally Coupled Electron Transfer

1 citations · 1 across the 3 of their papers we have counts for

collaborators

3 papers

physics.comp-ph2025

MaxwellLink: A unified framework for self-consistent light-matter simulations

Xinwei Ji, Andres Felipe Bocanegra Vargas, Gang Meng +1

A major challenge in light-matter simulations is bridging the disparate time and length scales of electrodynamics and molecular dynamics. Current computational approaches often rel…

physics.chem-ph2025

First-Principles Understanding of Vibrational Energy Transfer in Molecule-Surface Scattering: Both Adiabatic and Nonadiabatic Channels Matter

Gang Meng, Bin Jiang

Energy transfer during molecular collisions on metal surfaces plays a pivotal role in a host of critical interfacial processes. Despite significant efforts, our understanding of re…

cond-mat.mtrl-sci2024★ 1 cited

First-principles Nonadiabatic Dynamics of Molecules at Metal Surfaces with Vibrationally Coupled Electron Transfer

Gang Meng, James Gardner, Wenjie Dou +2

Accurate description of nonadiabatic dynamics of molecules at metal surfaces involving electron transfer has been a longstanding challenge for theory. Here, we tackle this problem…