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Theoretical and Computational Chemistry

Working Paper

A Computational Protocol Combining DFT and Cheminformatics for Prediction of pH-Dependent Redox Potentials

Rocco Peter Fornari, Piotr de Silva

Version 1 posted 09 June 2021

411

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Analytical Chemistry

Working Paper

Limited Accessibility to Surface Area Generated by Thermal Pretreatment of Electrodes Reduces Its Impact on Redox Flow Battery Performance

Katharine Greco, Jude Bonesteel, Nicolas Chanut, Charles Wan, Yet- Ming Chiang, Fikile Brushett

Version 1 posted 11 March 2021

537

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Energy

Working Paper

Comparison of Computational Chemistry Methods for the Discovery of Quinone-Based Electroactive Compounds for Energy Storage

Qi Zhang, Abhishek Khetan, Süleyman Er

Version 1 posted 31 August 2020

373

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Energy

Working Paper

Determining Performance Limits for Non-Aqueous Redox Flow Batteries

Zhijiang Tang, Aman Preet Kaur, Alan Pezeshki, Subrahmanyam Modekrutti, Frank Delnick, Thomas Zawodzinski, Gabriel Veith, Susan Odom

Version 1 posted 09 February 2021

537

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Energy

Working Paper

Exploring Eutectic Mixing of Quinones for Engineering High Energy-Density Electrolytes

Emily Penn, Antonio Baclig, Devi Ganapathi, William Chueh

Version 2 posted 24 January 2023

438

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Energy

Working Paper

Towards a mechanically-rechargeable solid fuel flow battery based on earth-abundant materials

Alexis M. Fenton, Jr., Yasser Ashraf Gandomi, Christopher T. Mallia, Bertrand J. Neyhouse, M. Aba Kpeglo, William E. Exson, Charles Tai-Chieh Wan, Fikile R. Brushett

Version 4 posted 20 September 2022

567

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Energy

Working Paper

Strategic Electrolyte Design to Address Solubility Competition between Redox-Active Molecules and Supporting Salts

Juran Noh, Heather Job, Hieu Doan, Kee Sung Han, Lily Robertson, Lu Zhang, Rajeev Surendran Assary, Karl Mueller, Vijayakumar Murugesan, Yangang Liang

Version 1 posted 10 September 2024

131

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Materials Chemistry

Working Paper

A Membrane-Electrolyte System Approach to Understanding Ionic Conductivity and Crossover in Alkaline Flow Cells

Thomas George, Isabelle Thomas, Naphtal Haya, John Deneen, Cliffton Wang, Michael Aziz

Version 1 posted 21 September 2023

471

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Theoretical and Computational Chemistry

Working Paper

RedDB, a Computational Database of Electroactive Molecules for Aqueous Redox Flow Batteries

Elif Sorkun, Qi Zhang, Abhishek Khetan, murat cihan sorkun, Süleyman Er

Version 1 posted 12 April 2021

921

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3

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Energy

Working Paper

Increased Performance of an all-Organic Redox Flow Battery model by Nitration of the [4]Helicenium Ion Electrolyte

Jules Moutet, David Mills, Md Mubarak Hossain, Thomas L. Gianetti

Version 1 posted 31 August 2021

330

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30 results in Redox flow battery in Keywords: Redox flow battery

A Computational Protocol Combining DFT and Cheminformatics for Prediction of pH-Dependent Redox Potentials

Limited Accessibility to Surface Area Generated by Thermal Pretreatment of Electrodes Reduces Its Impact on Redox Flow Battery Performance

Comparison of Computational Chemistry Methods for the Discovery of Quinone-Based Electroactive Compounds for Energy Storage

Determining Performance Limits for Non-Aqueous Redox Flow Batteries

Exploring Eutectic Mixing of Quinones for Engineering High Energy-Density Electrolytes

Towards a mechanically-rechargeable solid fuel flow battery based on earth-abundant materials

Strategic Electrolyte Design to Address Solubility Competition between Redox-Active Molecules and Supporting Salts

A Membrane-Electrolyte System Approach to Understanding Ionic Conductivity and Crossover in Alkaline Flow Cells

RedDB, a Computational Database of Electroactive Molecules for Aqueous Redox Flow Batteries

Increased Performance of an all-Organic Redox Flow Battery model by Nitration of the [4]Helicenium Ion Electrolyte

30 results in Keywords: Redox flow battery