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. The need to predict the transition state structure as input for quantum chemical barrier predictions adds further complications. Machine learning (ML) models of quantum chemistry can achieve fast and
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Supervisors: Supervisors: Dr. Albert Bartok-Partay (Physics), Prof. James Kermode (Engineering), Dr Livia Bartok-Partay (Chemistry) Summary: In high-performance applications such as aerospace and
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Supervisors: Dr. Ferran Brosa Planella, Dr. Radu Cimpeanu, Prof. Louis Piper Summary: Manufacturing not only has a significant impact on battery performance and lifetime, but also on cost and environmental impact. A key process (yet not a well-studied one) is the so-called filling, in which a...
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