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The ice/water interface: Molecular dynamics simulations of the basal, prism, {202̄1}, and {21̄1̄0} interfaces of ice Ih

✍ Scribed by Hayward, Jennifer A.; Haymet, A. D. J.

Book ID
120562060
Publisher
American Institute of Physics
Year
2001
Tongue
English
Weight
515 KB
Volume
114
Category
Article
ISSN
0021-9606

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✍ Taras Bryk; A.D.J. Haymet 📂 Article 📅 2004 🏛 Elsevier Science 🌐 English ⚖ 118 KB

The behavior of Na and Cl ions over a total time of 1.5 ns ice basal planeyvacuum interface is simulated with the SPCyE q y model of water molecules at a temperature close to the coexistence point. It is found that the Na ion stays for almost the whole q simulation time in the top broad ice surface