263 citations
- New York UniversityUS83 papers
- East China Normal UniversityCN64 papers
- Courant Institute of Mathematical SciencesUS23 papers
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- National Institute of InformaticsJP17 papers
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- Santa Fe InstituteUS7 papers
- Shanghai UniversityCN7 papers
- Chinese Academy of SciencesCN6 papers
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Showing 2023 · cond-mat.mtrl-sciShow all
2 papers · 2 filters
cond-mat.mtrl-sci2023★ 48 cited
Geometric Deep Learning for Molecular Crystal Structure Prediction
Michael Kilgour, Jutta Rogal, Mark Tuckerman
We develop and test new machine learning strategies for accelerating molecular crystal structure ranking and crystal property prediction using tools from geometric deep learning on…
cond-mat.mtrl-sci2023★ 19 cited
Spin State Disproportionation in Insulating Ferromagnetic LaCoO3 Epitaxial Thin Films
Shanquan Chen, Jhong-Yi Chang, Qinghua Zhang +14
The origin of insulating ferromagnetism in epitaxial LaCoO3 films under tensile strain remains elusive despite extensive research efforts have been devoted. Surprisingly, the spin…