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Atreyee Banerjee
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The role of structure and entropy in determining differences in dynamics for glass formers with different interaction potentials
A Banerjee, S Sengupta, S Sastry, SM Bhattacharyya
Physical Review Letter 113, 225701, 2014
772014
Unraveling the success and failure of mode coupling theory from consideration of entropy
MK Nandi, A Banerjee, S Sengupta, S Sastry, SM Bhattacharyya
The Journal of chemical physics 143 (17), 2015
372015
Determination of onset temperature from the entropy for fragile to strong liquids
A Banerjee, MK Nandi, S Sastry, S Maitra Bhattacharyya
The Journal of chemical physics 147 (2), 2017
362017
Role of the pair correlation function in the dynamical transition predicted by mode coupling theory
MK Nandi, A Banerjee, C Dasgupta, SM Bhattacharyya
Physical Review Letters 119 (26), 265502, 2017
252017
Effect of total and pair configurational entropy in determining dynamics of supercooled liquids over a range of densities
A Banerjee, MK Nandi, S Sastry, SM Bhattacharyya
J. Chem. Phys. 145, 034502, 2016
242016
Interplay between crystallization and glass transition in binary Lennard-Jones mixtures
A Banerjee, S Chakrabarty, SM Bhattacharyya
The Journal of chemical physics 139 (10), 2013
212013
Crystal structure prediction for benzene using basin-hopping global optimization
A Banerjee, D Jasrasaria, SP Niblett, DJ Wales
The Journal of Physical Chemistry A 125 (17), 3776-3784, 2021
162021
Composition dependence of the glass forming ability in binary mixtures: The role of demixing entropy
UK Nandi, A Banerjee, S Chakrabarty, SM Bhattacharyya
The Journal of chemical physics 145 (3), 2016
152016
Validity of the Rosenfeld relationship: a comparative study of the network forming NTW model and other simple liquids
A Banerjee, MK Nandi, SM Bhattacharyya
Journal of Chemical Sciences 129, 793-800, 2017
92017
Data-Driven Identification and Analysis of the Glass Transition in Polymer Melts
A Banerjee, HP Hsu, K Kremer, O Kukharenko
ACS Macro Lett. 12 (6), 679–684, 2023
82023
Side-chain polarity modulates the intrinsic conformational landscape of model dipeptides
D Chakraborty, A Banerjee, DJ Wales
The Journal of Physical Chemistry B 125 (22), 5809-5822, 2021
52021
Non-monotonic size dependence of diffusion and levitation effect: A mode-coupling theory analysis
MK Nandi, A Banerjee, SM Bhattacharyya
The Journal of Chemical Physics 138 (12), 2013
52013
Finite-size scaling and thermodynamics of model supercooled liquids: long-range concentration fluctuations and the role of attractive interactions
A Banerjee, M Sevilla, JF Rudzinski, R Cortes-Huerto
Soft Matter 18 (12), 2373-2382, 2022
42022
Energy landscapes for a modified repulsive Weeks–Chandler–Andersen potential
A Banerjee, DJ Wales
Journal of Physics: Condensed Matter 34 (3), 034004, 2021
42021
Fragility and correlated dynamics in supercooled liquids
A Banerjee, DJ Wales
The Journal of Chemical Physics 153 (12), 124501, 2020
42020
Determining glass transition in all-atom acrylic polymeric melt simulations using machine learning
A Banerjee, A Iscen, K Kremer, O Kukharenko
The Journal of Chemical Physics 159 (7), 2023
32023
Finite-size excess-entropy scaling for simple liquids
M Sevilla, A Banerjee, R Cortes-Huerto
The Journal of Chemical Physics 158 (20), 2023
2023
Data Driven characterisation of the Free Energy Landscape of Syndiotatic Polysterene
A Banerjee, Y Bozkurt Varolgünes, J Rudzinski, T Bereau
APS March Meeting Abstracts 2021, B26. 009, 2021
2021
Structure and dynamics of supercooled liquids: role of pair and higher order correlations
A Banerjee
CSIR-National Chemical Laboratory, Pune, 2016
2016
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Articles 1–19