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2021 Fiscal Year Final Research Report

Design of Active Oxygen Evolution Catalysts by Introducing Low Spin Electron Configurations into 3d Metal Materials

Research Project

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Project/Area Number 20K15387
Research Category

Grant-in-Aid for Early-Career Scientists

Allocation TypeMulti-year Fund
Review Section Basic Section 36020:Energy-related chemistry
Research InstitutionInstitute of Physical and Chemical Research

Principal Investigator

Ooka Hideshi  国立研究開発法人理化学研究所, 環境資源科学研究センター, 研究員 (90825994)

Project Period (FY) 2020-04-01 – 2022-03-31
Keywords電極触媒 / 触媒理論 / 機械学習
Outline of Final Research Achievements

A mathematical equation which predicts the reaction rate from the electrode potential was derived. Additionally, a machine learning method to fit the equation to the experimental data was developed. The results above were reported in ACS Catalysis (2021) as the first and corresponding author.

Free Research Field

電極触媒

Academic Significance and Societal Importance of the Research Achievements

水素社会を担う燃料電池や水素製造技術には、高効率な電極触媒が不可欠である。一方で、従来の触媒理論から優れた材料を予測することを困難である。このため、活性を予測するための理論構築を進めた。これは今後の触媒開発を促進する成果である。

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Published: 2023-01-30  

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