Peer-Reviewed Research

Mandal B., Jóźwiak H., Wcisło P., Naduvalath B.

Full-dimensional quantum scattering calculations of rovibrationally excited HD+HD collisions

Journal of Chemical Physics, 164, 124308, 2026

Stordock J., Mandal B., Naduvalath B.

Nuclear quantum effects on low energy resonant features in He+H₂ scattering

Physical Review A, , 113, 042803, 2026

Mandal B., Babikov D., Stancil P., Forrey R., Krems R., Naduvalath B.

Neural network ensemble for computing cross sections for rotational transitions in H₂O + H₂O collisions

Physical Chemistry Chemical Physics, 27, 23000, 2025

Honoring Prof. N. Sathyamurthy's 75th birthday

Santiago Perez-Hernando, Manuel Lara, Mandal B., Sanz-Sanz C., Jambrina P., Naduvalath B., Aoiz J.

Resonances in inelastic collisions of Ne+D₂ in the cold energy regime

Journal of Chemical Physics, 163, 224304, 2025

Sanz-Sanz C.*, Mandal B.* (*equal contribution), Jambrina P., Aoiz F. J., Naduvalath B.

Cold collisions of highly vibrationally excited and aligned D₂ with Ne

Journal of Chemical Physics, 162, 164307, 2025

Mandal B., Patkowski K., Jambrina P., Aoiz F. J., Naduvalath B.

Stereodynamics of cold HD and D₂ collisions with He

Journal of Chemical Physics, 162, 104201, 2025

Joy C., Bostan D., Mandal B., Babikov D.

Rate coefficients for rotational state-to-state transitions in H₂O + H₂ collisions as predicted by mixed quantum/classical theory

Astronomy & Astrophysics, 692, A229, 2024

Bostan D., Mandal B., Babikov D.

Mixed quantum/classical theory for rotationally inelastic scattering of identical collision partners revised

Physical Chemistry Chemical Physics, 26, 27567, 2024

Mandal B., Żółtowski M., Cordiner M., Lique F., Babikov D.

Rotational state-to-state transition rate coefficients for H₂O + H₂O collisions at non-equilibrium conditions

Astronomy & Astrophysics, 688, A208, 2024

Mandal B., Kroft J., Jambrina P., Guo H., Aoiz F. J., Naduvalath B.

Stereodynamical control of cold HD + D₂ collisions

Physical Chemistry Chemical Physics, 26, 18368, 2024

Joy C., Mandal B., Bostan D., Dubernet M. L., Babikov D.

Mixed quantum/classical theory (MQCT) approach to the dynamics of molecule–molecule collisions in complex systems

Faraday Discussions, 251, 225, 2024

Bostan D., Mandal B., Joy C., Żółtowski M., Lique F., Loreau J., Quintas-Sánchez E., Batista-Planas A., Dawes R., Babikov D.

Mixed quantum/classical calculations of rotationally inelastic scattering in the CO + CO systemCover

Physical Chemistry Chemical Physics, 26, 6627, 2024

Dubernet M. L., ..., Mandal B., ..., et al.

BASECOL2023 scientific content

Astronomy & Astrophysics, 683, A40, 2024

Mandal B., Bostan D., Joy C., Babikov D.

MQCT 2024: A program for calculations of inelastic scattering of two molecules

Computer Physics Communications, 294, 108938, 2024

Mandal B., Babikov D.

Improved temperature dependence of rate coefficients for rotational state-to-state transitions in H₂O + H₂O collisions

Astronomy & Astrophysics, 678, A51, 2023

Joy C., Mandal B., Bostan D., Babikov D.

Mixed quantum/classical theory for rotational energy exchange in symmetric-top-rotor + linear-rotor collisions: ND₃ + D₂

Physical Chemistry Chemical Physics, 25, 17287, 2023

Bostan D., Mandal B., Joy C., Babikov D.

Description of quantum interference using mixed quantum/classical theory of inelastic scattering

Physical Chemistry Chemical Physics, 25, 15683, 2023

Mandal B., Babikov D.

Rate coefficients for rotational state-to-state transitions in H₂O + H₂O collisions for cometary and planetary applications

Astronomy & Astrophysics, 671, A51, 2023

Mandal B., Joy C., Bostan D., Eng A., Babikov D.

Adiabatic trajectory approximation — new general method in the toolbox of mixed quantum/classical theory for collisional energy transferCover

The Journal of Physical Chemistry Letters, 14, 817, 2023

Mandal B., Joy C., Semenov A., Babikov D.

Mixed quantum/classical theory for collisional quenching of PAHs in the interstellar media

ACS Earth and Space Chemistry, 6, 521, 2022

Mandal B., Semenov A., Babikov D.

Adiabatic trajectory approximation within the framework of mixed quantum/classical theory

The Journal of Physical Chemistry A, 124, 9877, 2020

Boursier C., Mandal B., Dubernet M. L., Babikov D.

New H₂O-H₂O collisional rate coefficients for cometary applications

Monthly Notices of the Royal Astronomical Society, 498, 5489, 2020

Semenov A.*, Mandal B.* (*equal contribution), Babikov D.

MQCT: User-ready program for calculations of inelastic scattering of two molecules

Computer Physics Communications, 252, 107155, 2020

Mandal B., Semenov A., Babikov D.

Calculations of differential cross sections using mixed quantum/classical theory of inelastic scattering

The Journal of Physical Chemistry A, 122, 6157, 2018

Borgohain G., Mandal B., Paul S.

Molecular dynamics approach to understand the denaturing effect of a millimolar concentration of dodine on a λ-repressor

Physical Chemistry Chemical Physics, 19, 13160, 2017

Ray S., Mondal S., Mandal B., Bag B. C.

The role of interplay between the potential and ambient energies on the vibration energy harvesting

The European Physical Journal B, 89, 224, 2016

Mandal B., Bostan D., Joy C., Babikov D.

MQCT – A Program for Calculations of Inelastic Scattering of Two Molecules

VIRT&L-COMM, ISSN: 2279-8773, 25, 1, 2023