most citedThe Impact of Hydration Shell Inclusion and Chain Exclusion in the Efficacy of Reaction Coordinates for Homogeneous and Heterogeneous Ice Nucleation

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physics.chem-ph2025★ 2 cited

The Impact of Hydration Shell Inclusion and Chain Exclusion in the Efficacy of Reaction Coordinates for Homogeneous and Heterogeneous Ice Nucleation

Kimia Sinaeian, Amir Haji-Akbari

Ice nucleation plays a pivotal role in many natural and industrial processes, and molecular simulations play have proven vital in uncovering its kinetics and mechanisms. A fundamen…