35 citations · 87 across the 5 of their papers we have counts for
6 papers · 1 filter
Finite-size excess-entropy scaling for simple liquids
Mauricio Sevilla, Atreyee Banerjee, Robinson Cortes-Huerto
We introduce and validate a finite-size two-body excess entropy integral equation. By using analytical arguments and computer simulations of prototypical simple liquids, we show th…
Data-driven identification and analysis of the glass transition in polymer melts
Atreyee Banerjee, Hsiao-Ping Hsu, Kurt Kremer +1
Understanding the nature of glass transition, as well as precise estimation of the glass transition temperature for polymeric materials, remain open questions in both experimental…
Finite-size scaling and thermodynamics of model supercooled liquids: Long-range concentration fluctuations and the role of attractive interactions
Atreyee Banerjee, Mauricio Sevilla, Joseph F. Rudzinski +1
We compute partial structure factors, Kirkwood-Buff integrals (KBIs) and chemical potentials of model supercooled liquids with and without attractive interactions. We aim at invest…
The role of pair correlation function in the dynamical transition predicted by the mode coupling theory
Manoj Kumar Nandi, Atreyee Banerjee, Chandan Dasgupta +1
In a recent study we have found that for a large number of systems the configuration entropy at pair level, , which is primarily determined by the structural information, v…
Validity of the Rosenfeld relationship: A comparative study of the network forming NTW model and other simple liquids
Atreyee Banerjee, Manoj Kumar Nandi, Sarika Maitra Bhattacharyya
In this paper we explore the validity of the Rosenfeld and the Dzugutov relation for the Lennard-Jones (LJ) system, its repulsive counterpart, the WCA system and a network forming…
Determination of onset temperature from the entropy for fragile to strong liquids
Atreyee Banerjee, Manoj Kumar Nandi, Srikanth Sastry +1
In this paper we establish a connection between the onset temperature of glassy dynamics with the change in the entropy for a wide range of model systems. We identify the crossing…