Understanding the impact of ammonium ion substitutions on heterogeneous ice nucleation

Faraday Discuss., 2023, Advance Article
DOI: 10.1039/D3FD00097D, Paper
Open Access Open Access
Creative Commons Licence  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
Katarina E. Blow, Thomas F. Whale, David Quigley, Gabriele C. Sosso
We investigate the changes in enthalpy and configurational entropy under the insertion of an ammonium ion into ice. For a reasonable surface charge the most energetically stable configuration of ammonium in ice increases the configurational entropy.
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