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Materials 2024 (OMat24), or Open Catalyst 2022 (OC22), which will be used to refine the GenAI-proposed steps, and (iii) using the dataset generated by GenAI to parameterise kinetic Monte Carlo (KMC
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between theoretical and computational high-energy physics. The research contributes to the world-leading PYTHIA Monte Carlo Event Generator, which serves as the baseline for the majority of experimental
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