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The last 5 uploaded publications
Accurate and scalable exchange-correlation with deep learning
Giulia Luise, Chin‐Wei Huang, Thijs Vogels, Derk P. Kooi, Sebastian Ehlert, Stephanie Lanius, Klaas J. H. Giesbertz, Amir Karton, Deniz Gunceler, Megan Stanley, Wessel P. Bruinsma, Lin Huang, Xinran Wei, José I. Torres, Abylay Katbashev, Rodrigo Chavez Zavaleta, Bálint Máté, Sékou-Oumar Kaba, Roberto Sordillo, Y Z Chen, David B. Williams‐Young, Christopher Bishop, Jan Hermann, Rianne van den Berg, Paola Gori‐Giorgi (2025). Accurate and scalable exchange-correlation with deep learning. , DOI: https://doi.org/10.48550/arxiv.2506.14665.
Preprint12 days agoAccurate Chemistry Collection: Coupled cluster atomization energies for broad chemical space
Stephanie Lanius, Marwin Segler, Derk P. Kooi, Kenji Takeda, Chin‐Wei Huang, Giulia Luise, Rianne van den Berg, Paola Gori‐Giorgi, Amir Karton, Sebastian Ehlert, Jan Hermann, Thijs Vogels, Victor García Satorras (2025). Accurate Chemistry Collection: Coupled cluster atomization energies for broad chemical space. , DOI: https://doi.org/10.48550/arxiv.2506.14492.
Preprint12 days ago