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Author

A. Gupta

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Open access Oct 2026

Molecular Simulations Investigation of Deep Eutectic Solvent Induced Structural and Interfacial Behavior in Surfactant-Enhanced Oil Recovery Systems

Chemically enhanced oil recovery (c-EOR) relies heavily on surfactant-induced reduction of oil–water interfacial tension; however, the molecular-level role of deep eutectic solvent (DES) chemistry in surfactant-assisted interfacial stabilization remains poorly understood. In this work, atomistic molecular dynamics si...

Subodh Sinha, A. Gupta · 0 citations
Sep 2026

Ion Coordination and Clustering-Assisted Lithium Transport in Polymeric Ionic Liquids: A Molecular Dynamics Study

Polymerized ionic liquids (PILs) are promising solid-state electrolytes for lithium batteries, but the molecular mechanisms governing lithium-ion transport remain poorly understood. Here, atomistic molecular dynamics simulations were employed to investigate ion transport, polymer dynamics, and microstructural evoluti...

Vivek Shridhar Patil, A. Gupta · 0 citations

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