Techno-economic Modeling
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Estimating the Cost of Organic Battery Active Materials: A Case Study on Anthraquinone Disulfonic Acid
The cost of anthraquinone disulfonic acid (AQDS) production from anthracene feedstock is estimated based on a proposed series of process steps using three standard algorithms for process cost estimation. Read More
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Techno-Economic Modeling -- Building New Battery Systems on the Computer
JCESR is applying techno-economic models to project the performance and cost of a wide array of promising new battery systems before they are prototyped. The results from techno-economic modeling establish performance “floors” for discovery science teams looking for new anodes, cathodes, and electrolytes for a beyond lithium-ion battery, identifying those with the potential to meet JCESR’s goal and rejecting those unlikely to be effective. Read More
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Estimating the System Price of Redox Flow Batteries for Grid Storage
This work conducted a techno-economic analysis of a prospective production process for an aqueous all vanadium flow battery and a nonaqueous lithium polysulfide flow battery. Read More
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Pathways to Low-Cost Electrochemical Energy Storage: A Comparison of Aqueous and Nonaqueous Flow Batteries
First comprehensive determination of materials to system level performance and cost for nonaqueous and aqueous flow batteries for future and existing chemistries Read More
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A Review of Electrochemical Advances in Non-Aqueous Organic Redox Flow Batteries
Advances in electrolytes for non-aqueous redox flow batteries and computational tools for their discovery and prediction are reviewed and explored. Read More
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Realizing high zinc reversibility in rechargeable batteries
The first comprehensive comparison of the ~20 published studies evaluating Zn metal reversibility for rechargeable batteries shows significant variability in published test methods and parameters, and poor alignment toward commercial targets for zinc metal batteries. Significance and Impact … Read More
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Seeing Battery Solutions Move to Assess the Health of Batteries
Organic redox-active molecules (redoxmers) are popular for flow battery fluids. Their structural variability comes with other properties that may be tailored for function. We discovered that fluorescence emission can be engineered into redoxmers, which allows real-time tracing of species crossover in a liquid flow cell, … Read More
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Continuum description of the role of negative transference numbers on ion motion in polymer electrolytes
This theoretical study not only reveals time and space dependence of ion motion in the PEO/LiTFSI electrolyte having negative transference number, but also provide guidance to experimentalists seeking to detect the direction of ion motion in these electrolytes. Read More
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Probing calcium solvation by XAS, MD and DFT calculations
The solvation shell structures of Ca2+ in aqueous and organic solutions are probed by calcium L-edge soft X-ray absorption spectroscopy (XAS) and DFT/MD simulations. Read More
