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Combining Machine Learning and Quantum Chemistry for the Design of Homogeneous Catalysts

CORDIS provides links to public deliverables and publications of HORIZON projects.

Links to deliverables and publications from FP7 projects, as well as links to some specific result types such as dataset and software, are dynamically retrieved from OpenAIRE .

Publications

Deep learning metal complex properties with natural quantum graphs (opens in new window)

Author(s): Hannes Kneiding; Ruslan Lukin; Lucas Lang; Simen Reine; Thomas Bondo Pedersen; Riccardo De Bin; David Balcells
Published in: Digital Discovery, 2023, ISSN 2635-098X
Publisher: Royal Society of Chemistry
DOI: 10.1039/d2dd00129b

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