15 citations · 38 across the 4 of their papers we have counts for
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Unifying Mixed Gas Adsorption in Molecular Sieve Membranes and MOFs using Machine Learning
Subhadeep Dasgupta, Amal R S, Prabal K. Maiti
Recent machine learning models to accurately obtain gas adsorption isotherms focus on polymers or metal-organic frameworks (MOFs) separately. The difficulty in creating a unified m…
Trajectory Extending Kinetic Monte Carlo Simulations to Evaluate Pure and Gas Mixture Diffusivities through a Dense Polymeric Membrane
Subhadeep Dasgupta, Arun K. S, K. Ganapathy Ayappa +1
With renewed interest in CO2 separations, carbon molecular sieving (CMS) membrane performance evaluation requires diffusion coefficients as inputs to have reliable estimate of the…
Does twist angle affect the properties of water confined inside twisted bilayer graphene?
Jeet Majumdar, Subhadeep Dasgupta, Soham Mandal +3
Graphene nanoslit pore is used for nanofluidic devices like water desalination, ion-selective channels, ionic transistors, sensing, molecular sieving, blue energy harvesting, and p…
Dipole alignment of water molecules flowing through a carbon nanotube
Hemant Kumar, Saheb Bera, Subhadeep Dasgupta +3
The fast flow rate of water through nanochannels has promising applications in desalination, energy conversion, and nanomedicine. We have used molecular dynamics simulations to sho…