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A Review on Challenges and Successes in Atomic-Scale Design of Catalysts for Electrochemical Synthesis of Hydrogen Peroxide

Samira Siahrostami, Santiago Jimenez-Villegas, Amir Hassan Bagherzadeh Mostaghimi, Seoin Back, Amir Barati Farimani, Haotian Wang, Kristin Aslaug Persson, Joseph H. Montoya

📄 Abstract

Hydrogen peroxide is a valuable chemical oxidant with a wide range of applications in a variety of industrial processes, especially in water sanitization. Electrochemical synthesis of hydrogen peroxide (H 2 O 2 ) through a two-electron oxygen reduction reaction (2e-ORR) or a two-electron water oxidation reaction (2e-WOR) has emerged as an appealing process for onsite production of this chemically valuable oxidant. On-site produced H 2 O 2 can be applied for wastewater treatment in remote locations or any applications where H 2 O 2 is needed as an oxidizing agent. This Review studies the theoretical efforts in understanding the challenges in catalysis for electrochemical synthesis of H 2 O 2 as well as providing design principles for more efficient catalyst materials.

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