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Density, structure, and dynamics of water: The effect of van der Waals interactions

✍ Scribed by Wang, Jue; Román-Pérez, G.; Soler, Jose M.; Artacho, Emilio; Fernández-Serra, M.-V.


Book ID
118253851
Publisher
American Institute of Physics
Year
2011
Tongue
English
Weight
873 KB
Volume
134
Category
Article
ISSN
0021-9606

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Toward the description of van der Waals
✍ Lein, M.; Dobson, J. F.; Gross, E. K. U. 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 201 KB 👁 2 views

On the basis of the adiabatic connection formula we propose several approximations for the total correlation energy functional, which, in the limit of two separated neutral subsystems, correctly reproduce the van der Waals R y6 behavior. We have calculated the corresponding van der Waals coefficient