𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Monte Carlo Studies of Water in Crystal Hydrates

✍ Scribed by JULIA M. GOODFELLOW; P. LYNNE HOWELL; FRANÇOISE VOVELLE


Book ID
118723396
Publisher
John Wiley and Sons
Year
1986
Tongue
English
Weight
657 KB
Volume
482
Category
Article
ISSN
0890-6564

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✍ Michael R. Mruzik 📂 Article 📅 1977 🏛 Elsevier Science 🌐 English ⚖ 427 KB

The free energy, internal energy and entropy for water clusters of 8 and 64 molecules have been calculated using the Monte Carlo method and both the Lie-Clementi (C-XII) and Stillinger (ST2) potential functions. Detailed structural data for a cluster of 64 water molecules was also obtained by averag