The impact of hydration shell inclusion and chain exclusion in the efficacy of reaction coordinates for homogeneous and heterogeneous ice nucleation
Published in The Journal of Chemical Physics, 2025
A systematic study of how implementation choices affect reaction coordinates used to describe homogeneous and heterogeneous ice nucleation.
Recommended citation: K. Sinaeian and A. Haji-Akbari (2025). "The impact of hydration shell inclusion and chain exclusion in the efficacy of reaction coordinates for homogeneous and heterogeneous ice nucleation." The Journal of Chemical Physics 162, 164102.
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