12 citations · 12 across the 5 of their papers we have counts for
4 papers · 1 filter
Nonlinear Freezing of Vibrational Polariton Transport via Mesoscale Simulations
Xinwei Ji, Tao E. Li
Two-dimensional real-space imaging of vibrational polariton transport in planar Fabry--Pérot microcavities is numerically simulated via the mesoscale cavity molecular dynamics appr…
FermiLink: A Unified Agent Framework for Multidomain Autonomous Scientific Simulations
Gang Meng, Andres Felipe Bocanegra Vargas, Xinwei Ji +7
Artificial-intelligence (AI) agent frameworks have been developed for autonomous scientific simulations, but most current agent frameworks are tailored to a single or a small set o…
Two-dimensional IR-Raman spectroscopy of vibrational polaritons: Role of dipole surfaces
Xinwei Ji, Tomislav Begusic, Tao E. Li
Nonlinear spectroscopy provides a unique perspective to understand time-resolved molecular dynamics under vibrational strong coupling (VSC). Herein, equilibrium-nonequilibrium cavi…
Selective Excitation of IR-Inactive Modes via Vibrational Polaritons: Insights from Atomistic Simulations
Xinwei Ji, Tao E. Li
Vibrational polaritons, hybrid light-matter states formed between molecular vibrations and infrared (IR) cavity modes, provide a novel approach for modifying chemical reaction path…