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Physical Chemistry

Working Paper

Unveiling the Dance of Molecules: Ro-Vibrational Dynamics of Molecules under Intense Illumination at Complex Plasmonic Interfaces

Maxim Sukharev, Joseph Subotnik, Abraham Nitzan

Version 1 posted 05 December 2024

35

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Physical Chemistry

Working Paper

Cavity Quantum Electrodynamics Complete Active Space Configuration Interaction Theory

Nam Vu, Daniel Mejia-Rodriguez, Nicholas Bauman, Ajay Panyala, Erdal Mutlu, Niranjan Govind, Jonathan Foley

Version 1 posted 01 November 2023

434

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Theoretical and Computational Chemistry

Working Paper

Exact Factorization of the Photon-Electron-Nuclear Wavefunction: Formulation and Coupled-Trajectory Dynamics

Eduarda Sangiogo Gil, David Lauvergnat, Federica Agostini

Version 2 posted 21 June 2024

318

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Theoretical and Computational Chemistry

Working Paper

Analytical Derivative Approaches for Vibro-Polaritionic Structures and Properties

Xunkun Huang, WanZhen Liang

Version 1 posted 29 July 2024

196

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Physical Chemistry

Working Paper

Dynamics and Spectroscopy of Molecular Ensembles in a Lossy Microcavity

Inga Ulusoy, Oriol Vendrell

Version 2 posted 03 July 2020

533

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Theoretical and Computational Chemistry

Working Paper

Non-Hermitian Cavity Quantum Electrodynamics - Configuration Interaction Singles Approach for Polaritonic Structure with ab initio Molecular Hamiltonians

Jonathan McTague, Jonathan Foley

Version 2 posted 22 March 2022

512

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Organic Chemistry

Working Paper

On the SN2 Reactions Modified in Vibrational Strong Coupling Experiments: Reaction Mechanisms and Vibrational Mode Assignments

Clàudia Climent, Johannes Feist

Version 1 posted 21 August 2020

310

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Catalysis

Working Paper

Solvent Dependence on Cooperative Vibrational Strong Coupling and Cavity Catalysis

Jaibir Singh, Jyoti Lather, Jino GEORGE

Version 1 posted 04 May 2022

405

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1

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Nanoscience

Working Paper

The role of cavity losses on non-adiabatic couplings and dynamics in polaritonic chemistry

Panayiota Antoniou, Figen Suchanek, James F. Varner, Jonathan Foley

Version 4 posted 08 October 2020

904

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Physical Chemistry

Working Paper

Dissociation slowdown by collective optical response under strong coupling conditions

Maxim Sukharev, Joseph Subotnik, Abraham Nitzan

Version 1 posted 26 October 2022

105

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12 results in Polaritonic Chemistry in Keywords: Polaritonic Chemistry

Unveiling the Dance of Molecules: Ro-Vibrational Dynamics of Molecules under Intense Illumination at Complex Plasmonic Interfaces

Cavity Quantum Electrodynamics Complete Active Space Configuration Interaction Theory

Exact Factorization of the Photon-Electron-Nuclear Wavefunction: Formulation and Coupled-Trajectory Dynamics

Analytical Derivative Approaches for Vibro-Polaritionic Structures and Properties

Dynamics and Spectroscopy of Molecular Ensembles in a Lossy Microcavity

Non-Hermitian Cavity Quantum Electrodynamics - Configuration Interaction Singles Approach for Polaritonic Structure with ab initio Molecular Hamiltonians

On the SN2 Reactions Modified in Vibrational Strong Coupling Experiments: Reaction Mechanisms and Vibrational Mode Assignments

Solvent Dependence on Cooperative Vibrational Strong Coupling and Cavity Catalysis

The role of cavity losses on non-adiabatic couplings and dynamics in polaritonic chemistry

Dissociation slowdown by collective optical response under strong coupling conditions

12 results in Keywords: Polaritonic Chemistry