Publications of Mengnan Cui

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Journal Article (3)

2025
Journal Article
Cui, Mengnan, Karsten Reuter and Johannes Margraf: Multi-fidelity transfer learning for quantum chemical data using a robust density functional tight binding baseline.
MPG.PuRe
DOI
publisher-version
Journal Article
Poltavsky, Igor, Mirela Puleva, Anton Charkin-Gorbulin, Grégory Fonseca, Ilyes Batatia, d Nicholas J. Browning, Stefan Chmiela, Mengnan Cui, J.Thorben Frank, Stefan Heinen, Bing Huang, Silvan Käser, Adil Kabylda, Danish Khan, Carolin Müller, Alastair J.A. Price, Kai Riedmiller, Kai Töpfer, Tsz Wai Ko, Markus Meuwly, Matthias Rupp, Gábor Csányi, O.Anatole von Lilienfeld, Johannes T. Margraf, Klaus-Robert Müller and Alexandre Tkatchenko: Crash testing machine learning force fields for molecules, materials, and interfaces: molecular dynamics in the TEA challenge 2023.
MPG.PuRe
DOI
publisher-version
2024
Journal Article
Cui, Mengnan, Karsten Reuter and Johannes Margraf: Obtaining Robust Density Functional Tight-Binding Parameters for Solids across the Periodic Table.
MPG.PuRe
DOI
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