5 papers
Light-Matter Entanglement in Real-Time Nuclear-Electronic Orbital Polariton Dynamics
Millan F. Welman, Tao E. Li, Sharon Hammes-Schiffer
Molecular polaritons are hybrid light-matter states that enable the exploration of potential cavity-modified chemistry. The development of dynamical, first-principles approaches fo…
FDTD with Auxiliary Bath Fields for Condensed-Phase Polaritonics: Fundamentals and Implementation
Tao E. Li
Understanding condensed-phase polariton experiments requires accurately accounting for both realistic cavity geometries and the interplay between polaritons and material dark modes…
Magnetic Interactions between Nanoscale Domains in Correlated Liquids
Mohammadhasan Dinpajooh, Giovanna Ricchiuti, Andrew J. Ritchhart +6
The formation of nanoscale domains (NDs) in correlated liquids and the emerging collective magnetic properties have been suggested as key mechanisms governing ion transport under e…
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…
Polariton-induced Purcell effects via a reduced semiclassical electrodynamics approach
Andres Felipe Bocanegra Vargas, Tao E. Li
Recent experiments have demonstrated that polariton formation provides a novel strategy for modifying local molecular processes when a large ensemble of molecules is confined withi…