Publications

Equal Contribution     * Corresponding Author 

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Investigating the Collective Nature of Cavity Modified Chemical Kinetics under Vibrational Strong Coupling

L Lindoy, A Mandal , D Reichman *

Nanophotonics
accepted (2024)
linkpdf4
Citations 

Variational Lang-Firsov approach plus Møller-Plesset perturbation theory with applications to ab initio polariton chemistry

Z Cui *, A Mandal , D Reichman *

Journal of Chemical Theory and Computation
20 (3) 1143–1156 (2024)
linkpdf10
Citations 

A Theory for Cavity Modified Ground-State Reactivities via Electron-Photon Interactions

A Mandal M. Taylor , P Huo * ,

The Journal of Physical Chemistry A
127 (32) 6635 (2023)
linkpdf7
Citations 
Journal
Cover

Quasi-Diabatic Propagation Scheme for Simulating Polariton Chemistry

D Hu*, A Mandal, B Weight, P. Huo *

The Journal of Chemical Physics
157 (10) 104118 (2022)
linkpdf10+
Citations 

Resonant Cavity Modification of Ground State Chemical Kinetics

L Lindoy, A Mandal, D Reichman *

The Journal of Physical Chemistry Letters
13 (28) 6580 (2022)
linkpdf30+
Citations 
Journal
Cover

Nuclear Gradient Expressions for Molecular Cavity Quantum Electrodynamics Simulations using the Mixed Quantum-Classical Methods

W Zhou, D Hu, A Mandal, P Huo*

The Journal of Chemical Physics
157 (10), 104118 (2022)
linkpdf5+
Citations 

Incorporating Lindblad Decay Dynamics into Mixed Quantum-Classical Simulations

E Koessler* , A Mandal, P Huo*

The Journal of Chemical Physics
157 (6) 064101  (2022)
linkpdf10+
Citations 

Resolving Ambiguities of the Mode Truncation in Cavity Quantum Electrodynamics

M Taylor, A Mandal, P Huo*

Optics Letters
47 (6) 1446 (2022)
linkpdf20+
Citations 

Theory of Vibrational Polariton Chemistry in the Collective Coupling Regime

A Mandal*, X. Li, P Huo*

The Journal of Chemical Physics
156 (1) 014101 (2022)
linkpdf50+
Citations 

Ab-initio Symmetric Quasi-Classical Approach to Investigate Molecular Tully Models

B Weight, A Mandal, P Huo*

The Journal of Chemical Physics
155 (8) 084106  (2021)
linkpdf10+
Citations 

Polariton Induced Conical Intersection and Berry Phase

M Farag, A Mandal, P Huo*

Physical  Chemistry Chemical Physics
23 (31) 16868  (2021)
linkpdf20+
Citations 

Theory of Mode-Selective Chemistry through Polaritonic Vibrational Strong Coupling

X Li*, A Mandal*, P Huo*

The Journal of Physical Chemistry Letters
12 (29) 6974 (2021)
linkpdf50+
Citations 

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

L Qiu, A Mandal, O Morshed, M Meidenbauer, W Girten, P Huo*, A Vamivakas*, T Krauss*

The Journal of Physical Chemistry Letters
12 (20) 5030  (2021)
linkpdf30+
Citations 
Journal
Cover

Ring-Polymer Quantization of Photon Field in Polariton Chemistry

S Chowdhury, A Mandal , P Huo*

The Journal of Chemical Physics
154 (4) 044109 (2021)
linkpdf30+
Citations 
Journal
Cover

Polariton Mediated Electron Transfer via Cavity Quantum Electrodynamics

A Mandal*, T D Krauss*, P Huo*

The Journal of Physical Chemistry B
124(29) 6321 (2020)
linkpdf130+
Citations 
Top Cited
at JPCB

Quasi-Diabatic Scheme for Nonadiabatic
On-the-Fly Simulations

W Zhou, A Mandal, P Huo*

The Journal of Physical Chemistry Letters
10 (22), 7062 (2019)
linkpdf30+
Citations 

Quasi Diabatic Propagation Scheme for Direct Simulation of Proton-Coupled Electron Transfer Reaction

A Mandal, J S Sandoval, F A Shakib*, P Huo*

The Journal of Physical Chemistry A
123 (12), 2470 (2019)
linkpdf10+
Citations 

Symmetric Quasi-Classical Dynamics With Quasi-Diabatic Propagation Scheme

J S Sandoval, A Mandal, P Huo*

The Journal of Chemical Physics
149 (4), 044115 (2018)
linkpdf20+
Citations 

Investigating Photoinduced Proton Coupled Electron Transfer Reaction using Quasi Diabatic Dynamics Propagation

A Mandal, F A Shakib, P Huo*

The Journal of Chemical Physics
148 (24), 244102 (2018)
linkpdf20+
Citations 

Modulating Nonlinear Optical Properties of Impurity Doped Quantum Dots via the Interplay Between Anisotropy and Gaussian White Noise

S Sarkar, A Ghosh, A Mandal, M Ghosh*

Superlattices and Microstructures
90, 297-307 (2016)
linkpdf10+
Citations 

Influence of Position-Dependent Effective Mass on the Nonlinear Optical Properties of Impurity Doped Quantum Dots in Presence of Gaussian White Noise

A Ghosh, A Mandal, S Sarkar, M Ghosh*

Optics Communication
367, 325-334 (2016)
linkpdf40+
Citations 

Analyzing Total Optical Absorption Coefficient of Impurity Doped Quantum Dots in Presence of Noise With Special Emphasis on Electric Field, Magnetic Field and Confinement Potential

A Mandal , S Sarkar, A Ghosh, M Ghosh*

Chemical Physics
463, 149-158 (2015)
linkpdf30+
Citations 

Diffusion of Small Solute Particles in Viscous Liquids: Cage Diffusion, a Result of Decoupling of Solute–Solvent Dynamics, Leads to Amplification of Solute Diffusion

S Acharya, M K Nandi, A Mandal, S Sarkar, S M Bhattacharyya*

The Journal of Physical Chemistry B
119 (34), 11169-11175 (2015)
linkpdf15+
Citations