Kavanagh, Seán R.

1. High-performance training and inference for deep equivariant interatomic potentials
   2025/04/22 by Tan, Chuin Wei, Descoteaux, Marc L., Kotak, Mit +11 · 13 citations
   #Chemical Physics (physics.chem-ph) #Computational Physics (physics.comp-ph) #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG)
2. Chalcogen Vacancies Rule Charge Recombination in Pnictogen Chalcohalide Solar-Cell Absorbers
   2025/04/25 by López, Cibrán, Kavanagh, Seán R., Benítez, Pol +4 · 3 citations
   #FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci)
3. Identifying Split Vacancy Defects with Machine-Learned Foundation Models and Electrostatics
   2024/12/26 by Sean Kavanagh, Seán R. Kavanagh, Kavanagh, Seán R. · 1 voice · 2 citations
   Materials Science · Chemical Engineering · Chemistry · #Machine Learning in Materials Science #Catalysis and Oxidation Reactions #Inorganic Chemistry and Materials
4. Defect-Limited Efficiency of Pnictogen Chalcohalide Solar Cells
   2025/12/01 by Cibrán López, Seán R. Kavanagh, López, Cibrán +11 · 1 citation
   Energy · Engineering · #Chalcogenide Semiconductor Thin Films #FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci) #Perovskite Materials and Applications #TiO2 Photocatalysis and Solar Cells