Enhanced Oil recovery (EOR) processes include all methods that use external sources of energy or materials to recover the oil that cannot be produced economically by conventional means. We use multi-scale modelling techniques to model various aspects of EOR process.

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The main objective of this section is to predict physico-chemical properties of materials. Further complex phase behaviour involving ionic liquid, deep eutectic solvent as well as volatile organic materials are predicted by Quantum Chemical combined with Statistical Mechanical approaches. 

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The main objective is to predict the structural and transport properties of pure components and mixtures by molecular dynamics simulation.

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The main objective of the research is to develop state-of-the-art eutectogels for lithium ion batteries.

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Amine boranes are novel hydrogen storage materials. Hydrogen is produced from amine boranes using ionic liquid as liquid catalyst. The main objective is to predict the reaction mechanism of dehydrogenation of amine borane/ionic liquid system and investigation of various interactions through Quantum Chemical calculation.

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