Accelerating the screening of catalysts for hydrogen evolution reaction in graphene materials based on DFT calculations and machine learning DOI

Zikai Xiong,

Shengjun Huo,

Wanglai Cen

et al.

Molecular Catalysis, Journal Year: 2025, Volume and Issue: 581, P. 115152 - 115152

Published: April 25, 2025

Language: Английский

Unveiling High-Efficiency Catalysis for CO Oxidation on Double-Atom Catalysts Supported by Defective Boron Nitride: A First-Principles Investigation DOI
Ratchadaree Intayot, Siriporn Jungsuttiwong

Journal of environmental chemical engineering, Journal Year: 2025, Volume and Issue: unknown, P. 116569 - 116569

Published: April 1, 2025

Language: Английский

Citations

0
Accelerating the screening of catalysts for hydrogen evolution reaction in graphene materials based on DFT calculations and machine learning DOI

Zikai Xiong,

Shengjun Huo,

Wanglai Cen

et al.

Molecular Catalysis, Journal Year: 2025, Volume and Issue: 581, P. 115152 - 115152

Published: April 25, 2025

Language: Английский

Citations

0