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Predicting Atomistic Transitions with Transformers

Accurate knowledge of the atomistic transition pathways in materials and material surfaces is crucial for many material science problems. However, conventional simulation techniques used to find these transitions are extremely computationally intensive. Even with large-scale, accelerated material si...

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Bibliografische gegevens
Hoofdauteurs: Henry Tischler, Wenting Li, Qi Tang, Danny Perez, Thomas Vogel
Formaat: Artigo
Taal:Inglês
Gepubliceerd in: Taylor & Francis Group 2026-12-01
Reeks:Data Science in Science
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Online toegang:https://www.tandfonline.com/doi/10.1080/26941899.2026.2685344
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