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Simple model for liquid water

✍ Scribed by Sánchez, Gabriel; Costas, María Eugenia; Varea, Carmen

Book ID
120504524
Publisher
American Institute of Physics
Year
1987
Tongue
English
Weight
458 KB
Volume
86
Category
Article
ISSN
0021-9606

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📜 SIMILAR VOLUMES

A novel approach for designing simple po
A novel approach for designing simple point charge models for liquid water with three interaction sites
✍ Alice Glättli; Xavier Daura; Wilfred F. Van Gunsteren 📂 Article 📅 2003 🏛 John Wiley and Sons 🌐 English ⚖ 166 KB

## Abstract A simultaneous improvement of the diffusion and dielectric properties of the simple point charge (SPC) model for liquid water appears to be very difficult with conventional reparametrization of the commonly used Lennard–Jones and Coulomb interaction functions and without including a sel