Editorial Board
18 Editors in 7 Countries/Regions
Editor-in-Chief
Hao Li
[email protected]Distinguished Professor, Digital Catalysis & Battery Lab (DigCat & DigBat), Advanced Institute for Materials Research (WPI-AIMR), Tohoku University, Sendai, Japan.
Research Interests: AI for materials; Catalysis theory; Digital catalysis; Machine learning; Density functional theory
Associate Editors
Xiaoguang Duan
Associate Professor, School of Chemical Engineering and Advanced Materials, The University of Adelaide, Adelaide, Australia.
Research Interests: materials; Catalysis; DFT; environment; nanotechnologies
Graeme A. Henkelman
Professor, Department of Chemistry and the Oden Institute for Computational Engineering and Sciences, The University of Texas at Austin, Austin, Texas, USA.
Research Interests: Machine Learning, computational chemistry, catalysis, transition state theory, density functional theory
Weijie Yang
Associate Professor, Department of Power Engineering, North China Electric Power University,Baoding, Hebei, China.
Research Interests: AI Agent for energy and catalysis materials; Hydrogen Energy; Digital Hydrogen Database and AI Agent
Editorial Board Members
Vitaly Alexandrov
Associate Professor, Chemical & Biomolecular Engineering, University of Nebraska–Lincoln, NE, USA.
Research Interests: electronic-structure theory; ab initio molecular dynamics; computational electrochemistry; electrocatalysis; batteries; data science
Benjamin W.J. Chen
Senior Research Scientist, Institute of High Performance Computing, Agency for Science, Technology and Research (A*STAR), Singapore.
Research Interests: Machine Learning; Computational Catalysis; High Throughput; Multiscale Modeling; Materials Science
Zhongfang Chen
Professor, Department of Chemistry, University of Puerto Rico, Río Piedras Campus, San Juan, Puerto Rico, USA.
Research Interests: Physical chemistry; computational chemistry; nanomaterials science; nanocatalysis; energy storage; energy conversion, green energy
Eric jianfeng Cheng
Associate Professor, Core Research Cluster for Materials Science (CRC‑MS), Advanced Institute for Materials Research, Tohoku University, Sendai, Japan.
Research Interests: Solid Electrolyte; Solid-state Batteries; Ceramics; Mechanical Properties; Al-Assisted Machine Learning
Ikutaro Hamada
Associate Professor, Department of Precision Science and Technology, Graduate School of Engineering, Osaka University, Osaka, Japan.
Research Interests: Electronic structure theory; density functional theory; many body perturbation theory; surface science; electrochemistry
Jingwei Hou
Associate Professor, School of Chemical Engineering and Advanced Materials, University of Queensland, Brisbane, Queensland, Australia.
Research Interests: physical and chemical properties of microporous glass materials, realising efficient separation, catalysis and energy applications
Piao Ma
CTO, MatSource AI Co Itd., Suzhou, Jiangsu, China.
Research Interests: AI Agent; Material science; First principle calculation; Molecular Dynamics; Solid state electrolytes; Catalysts
Claudio Pistidda
Department Head and Group Leader, Department of Materials Design, Institute of Hydrogen Technology, Helmholtz-Zentrum hereon GmbH, Germany.
Research Interests: Machine learning for energy; hydrogen storage; materials chemistry; materials design
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Aloysius Soon
Professor, Department of Materials Science & Engineering, Yonsei University, Seoul, South Korea.
Research Interests: Density-functional theory; Theoretical surface and interface science; Digital materials design; Artificial/Natural intelligence algorithms for materials optimization
Chenghua Sun
Associate Professor, Computational Materials and Catalysis Group, School of Science, Swinburne University of Technology, Melbourne, Australia.
Research Interests: Battery; Computational; Chemistry; CO2; Ammonia; SynthesisHydrogen
Hongtao Wang
Associate Professor, Department of Computer, North China Electric Power University, Baoding, Hebei, China.
Research Interests: Trustworthy Machine learning; Large Language Models; AI security; AI for Science; Anomaly Detection; Adversarial Attack and Defense
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Xiaonan Wang
Associate Professor, Department of Chemical Engineering, Tsinghua University, Beijing, China.
Research Interests: Smart city and urban systems development; Multi-scale systems modelling, automation and optimization; Novel machine learning, AI and IoT technologies applied in Energy, Environment and Sustainability related research; Energy and process systems engineering; Life cycle sustainability assessment
Jianping Xiao
Research Fellow, Division of Theoretical and Computational Chemistry, Dalian Institute of Chemical Physics, Chinese Academy of Sciences, Dalian, Liaoning, China.
Research Interests: Construction and analysis of multiphase catalytic reaction phase diagrams; Development of self-consistent microscopic reaction kinetics models; Application of machine learning in catalyst design; Experimental research on energy and environmental catalysis
Chaoyue Zhao
Associate Professor, Industrial & Systems Engineering, University of Washington, Seattle, WA, USA.
Research Interests: data-driven optimization methodologies to support strategic and operational planning in power systems management
All members of the Editorial Board have identified their affiliated institutions or organizations, along with the corresponding country or geographic region. OAE Publishing Inc. remains neutral with regard to any jurisdictional claims.
