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个人简介
Mickael Delcey is a researcher at the Department of Theoretical Chemistry and Biology at KTH Royal Institute of Technology, Stockholm, Sweden.
His main focus is the development of quantum chemical methods able to accurately describe systems with strong (also called static) correlation. These are cases for which the intuitive concept of molecular orbital breaks down, and thus a single Slater determinant does not give an even qualitatively reasonable picture of the electronic structure
Mickael's interests are in particular red-ox catalysist with multiple transition metals, both in biological (hydrogenase, oxygen-evolving complex and nitrogenase for example) and in synthetic systems
研究兴趣
论文共 59 篇作者统计合作学者相似作者
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Journal of chemical theory and computationno. 6 (2024): 2423-2432
arxiv(2024)
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Advances in Ultrafast Condensed Phase Physics IV (2024)
Giovanni Li Manni, Ignacio Fernández Galván,Ali Alavi,Flavia Aleotti,Francesco Aquilante,Jochen Autschbach,Davide Avagliano,Alberto Baiardi, Jie J. Bao,Stefano Battaglia, Letitia Birnoschi,Alejandro Blanco-González,
crossref(2023)
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2023)
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Journal of chemical theory and computationno. 10 (2023): 2863-2872
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