most citedInfluence of molecular shape on self-diffusion under severe confinement: A molecular dynamics study

9 citations · 11 across the 3 of their papers we have counts for

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physics.chem-ph2024

Mixtures of Ethane with CO and Water Simulated in ZSM-22: The Role of Polarity and Hydrogen Bonding

Mohammed Musthafa Kummali, David Cole, Siddharth Gautam

Deciphering the interplay between confinement effects and intermolecular interactions in zeolites is crucial for understanding diverse diffusion behaviors of confined molecules. Re…

physics.chem-ph2018★ 9 cited

Influence of molecular shape on self-diffusion under severe confinement: A molecular dynamics study

I. Dhiman, U. R. Shrestha, D. Bhowmik +2

We have investigated the effect of molecular shape and charge asymmetry on the translation dynamics of confined hydrocarbon molecules having different shapes but similar kinetic di…