Theory of vibrational polariton chemistry in the collective coupling regime

Ground state properties and infrared spectra of anharmonic vibrational polaritons of small molecules in cavities

(2021) Eric W. Fischer et al.   JOURNAL OF CHEMICAL PHYSICS

Nonequilibrium effects of cavity leakage and vibrational dissipation in thermally activated polariton chemistry

(2021) Matthew Du et al.   JOURNAL OF CHEMICAL PHYSICS

Cavity frequency-dependent theory for vibrational polariton chemistry

(2021) Xinyang Li et al.   Nature Communications

Reproducibility of cavity-enhanced chemical reaction rates in the vibrational strong coupling regime

(2021) Mario V. Imperatore et al.   JOURNAL OF CHEMICAL PHYSICS

Molecular Polaritons Generated from Strong Coupling between CdSe Nanoplatelets and a Dielectric Optical Cavity

(2021) Liangyu Qiu et al.   Journal of Physical Chemistry Letters

Theory of Mode-Selective Chemistry through Polaritonic Vibrational Strong Coupling

(2021) Xinyang Li et al.   Journal of Physical Chemistry Letters

Quantum Effects in Chemical Reactions under Polaritonic Vibrational Strong Coupling

(2021) Pei-Yun Yang et al.   Journal of Physical Chemistry Letters

Cavity catalysis: modifying linear free-energy relationship under cooperative vibrational strong coupling

(2021) Jyoti Lather et al.   Chemical Science

Modulation of Prins Cyclization by Vibrational Strong Coupling

(2020) Kenji Hirai et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Relevance of the quadratic diamagnetic and self-polarization terms in cavity quantum electrodynamics

(2020) Christian Schaefer et al.   ACS Photonics

Polaritonic normal modes in transition state theory

(2020) Jorge A. Campos-Gonzalez-Angulo et al.   JOURNAL OF CHEMICAL PHYSICS

Vacuum field in a cavity, light-mediated vibrational coupling, and chemical reactivity

(2020) Vladimir P. Zhdanov   CHEMICAL PHYSICS

On the origin of ground-state vacuum-field catalysis: Equilibrium consideration

(2020) Tao E. Li et al.   JOURNAL OF CHEMICAL PHYSICS

Resolution of Gauge Ambiguities in Molecular Cavity Quantum Electrodynamics

(2020) Michael A. D. Taylor et al.   PHYSICAL REVIEW LETTERS

Improving Enzyme Catalytic Efficiency by Co-operative Vibrational Strong Coupling of Water

(2020) Jyoti Lather et al.   Journal of Physical Chemistry Letters

Tilting a ground-state reactivity landscape by vibrational strong coupling

(2019) A. Thomas et al.   SCIENCE

Cavity Catalysis by Cooperative Vibrational Strong Coupling of Reactant and Solvent Molecules

(2019) Jyoti Lather et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Cavity Casimir-Polder Forces and Their Effects in Ground-State Chemical Reactivity

(2019) Javier Galego et al.   Physical Review X

Modification of Enzyme Activity by Vibrational Strong Coupling of Water

(2019) Robrecht M. A. Vergauwe et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Engineering spin-orbit synthetic Hamiltonians in liquid-crystal optical cavities

(2019) Katarzyna Rechcińska et al.   SCIENCE

Resonant catalysis of thermally activated chemical reactions with vibrational polaritons

(2019) Jorge A. Campos-Gonzalez-Angulo et al.   Nature Communications

Light–matter interaction in the long-wavelength limit: no ground-state without dipole self-energy

(2018) Vasil Rokaj et al.   JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS

Polariton chemistry: controlling molecular dynamics with optical cavities

(2018) Raphael F. Ribeiro et al.   Chemical Science

Tensor Network Simulation of Non-Markovian Dynamics in Organic Polaritons

(2018) Javier del Pino et al.   PHYSICAL REVIEW LETTERS

Cavity Born–Oppenheimer Approximation for Correlated Electron–Nuclear-Photon Systems

(2017) Johannes Flick et al.   Journal of Chemical Theory and Computation

Transport of ions and electrons in nanostructured liquid crystals

(2017) Takashi Kato et al.   Nature Reviews Materials

Rate Coefficients of the HCl + OH → Cl + H2O Reaction from Ring Polymer Molecular Dynamics

(2016) Junxiang Zuo et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Multiple Rabi Splittings under Ultrastrong Vibrational Coupling

(2016) Jino George et al.   PHYSICAL REVIEW LETTERS

Coherent coupling of molecular resonators with a microcavity mode

(2015) A. Shalabney et al.   Nature Communications

Mixed quantum classical calculation of proton transfer reaction rates: From deep tunneling to over the barrier regimes

(2014) Weiwei Xie et al.   JOURNAL OF CHEMICAL PHYSICS

Vibrationally Assisted Polariton-Relaxation Processes in Strongly Coupled Organic-Semiconductor Microcavities

(2011) David M. Coles et al.   ADVANCED FUNCTIONAL MATERIALS

Quantum rate dynamics for proton transfer reaction in a model system: Effect of the rate promoting vibrational mode

(2011) Qiang Shi et al.   JOURNAL OF CHEMICAL PHYSICS

Accurate quantum-mechanical rate constants for a linear response Azzouz-Borgis proton transfer model employing the multilayer multiconfiguration time-dependent Hartree approach

(2011) Ian R. Craig et al.   JOURNAL OF CHEMICAL PHYSICS

Nonadiabatic Effects on Proton Transfer Rate Constants in a Nanoconfined Solvent

(2010) Being J. Ka et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Quantum rate dynamics for proton transfer reactions in condensed phase: The exact hierarchical equations of motion approach

(2009) Liping Chen et al.   JOURNAL OF CHEMICAL PHYSICS

Effective-mode representation of non-Markovian dynamics: A hierarchical approximation of the spectral density. I. Application to single surface dynamics

(2009) Keith H. Hughes et al.   JOURNAL OF CHEMICAL PHYSICS

Proton transfer in a polar solvent from ring polymer reaction rate theory

(2008) Rosana Collepardo-Guevara et al.   JOURNAL OF CHEMICAL PHYSICS