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Multiscale Modeling Of Electrolytes For Energy Storage And Conversion, Fatemeh Sepehr

Doctoral Dissertations

Fuel cells, redox flow batteries, and secondary ion batteries are under active investigation to fulfill the requirements of efficient and sustainable energy storage and conversion technologies. The discovery of high-performance stable electrolytes that are relatively cheap and versatile is crucial to the commercialization of these electrochemical devices and necessitates a comprehensive understanding of the materials (i.e., from the atomistic to continuum levels). This dissertation is on multiscale modeling and simulations of several electrolytes under consideration in vanadium redox flow batteries (VRFBs), alkaline fuel cells (AFCs), or secondary magnesium batteries.

The hydrated structure and associated solvation Gibbs energies were determined for …

Experimental And Modeling Studies In Membrane Distillation, Lin Li

Dissertations

A variety of microporous hydrophobic flat sheet membranes of polyvinylidene fluoride (PVDF) and expanded-polytetrafluoroethylene (e-PTFE) are studied to evaluate the influence of membrane properties on their performance in desalination by direct contact membrane distillation (DCMD) and vacuum membrane distillation (VMD) processes. The membrane thickness is varied between 23 μm to 125 μm; the pore size is varied from 0.05 μm to 0.45 μm. The porosity is generally high in the range of 0.7 - 0.8. DCMD experiments are performed over a hot brine temperature range of 65 °C to 85 °C and distillate temperature at 25 °C for various brine …