Publications

Equal Contribution     * Corresponding Author 

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

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

chemRxiv
(2022)
linkpdf

Ultrafast Imaging of Polariton Propagation and Interactions

D Xu, A Mandal, J Baxter, S Cheng, I Lee, I Su, S Liu, D Reichman, M Delor *

arXiv
(2022)
linkpdf

Resonant Cavity Modification of Ground State Chemical Kinetics

L Lindoy, A Mandal, D Reichman *

The Journal of Physical Chemistry Letters
accepted (2022)
linkpdf

Incorporating Lindblad Decay Dynamics into Mixed Quantum-Classical Simulations

E Koessler* , A Mandal, P Huo*

The Journal of Chemical Physics
accepted (2022)
linkpdf

Resolving Ambiguities of the Mode Truncation in Cavity Quantum Electrodynamics

M Taylor, A Mandal, P Huo*

Optics Letters
47 (6) 1446 (2022)
linkpdf

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)
linkpdf

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)
linkpdf

Polariton Induced Conical Intersection and Berry Phase

M Farag, A Mandal, P Huo*

Physical  Chemistry Chemical Physics
23 (31) 16868  (2021)
linkpdf

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)
linkpdf

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

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

The Journal of Physical Chemistry Letters
12 (20) 5030  (2021)
linkpdf


Supplementary
Cover

See Cover at link 

 

Cavity Frequency-Dependent Theory for Vibrational Polariton Chemistry

X Li, A Mandal* , P Huo*

Nature Communications
12 (1) 1315  (2021)
linkpdf


Featured
 Article

Featured in the 'Inorganic and Physical Chemistry' Section

 

Ring-Polymer Quantization of Photon Field in Polariton Chemistry

S Chowdhury, A Mandal , P Huo*

The Journal of Chemical Physics
154 (4) 044109 (2021)
linkpdf

Polarized Fock States and the Dynamical Casimir Effect in Molecular Cavity Quantum Electrodynamics

A Mandal*, S M Vega, P Huo*

The Journal of Physical Chemistry Letters
11 (21) 9215  (2020)
linkpdf


Supplementary
Cover

See Cover at link 

 

Resolution of Gauge Ambiguities in Molecular Cavity Quantum Electrodynamics

M Taylor, A Mandal, W Zhou, P Huo*

Physical Review Letters
125 (12) 123602  (2020)
linkpdf

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)
linkpdf

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)
linkpdf

Investigating New Reactivities Enabled by Polariton Photochemistry

A Mandal, P Huo*

The Journal of Physical Chemistry Letters
10 (18), 5519 (2019)
linkpdf


Top Cited
at JPCL

Among "Top Cited Articles Published in 2019 and 2020" at JPCL. link 


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)
linkpdf

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)
linkpdf

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)
linkpdf

Quasi-Diabatic Representation for Nonadiabatic Dynamics Propagation

A Mandal, SRKC Yamijala, P Huo*

Journal of Chemical Theory and Computation
14 (4), 1828-1840 (2018)
linkpdf


at Visva-Bharati (during M.Sc.)

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)
linkpdf

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)
linkpdf

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)
linkpdf


at NCL, Pune (Summer Internship during B. Sc.)

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)
linkpdf