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Molecular Dynamics Simulations of Polycarbonate Doped with Lemke Chromophores

✍ Scribed by Zhang, Qiong; Tu, Yaoquan; Tian, He; Ågren, Hans


Book ID
127196841
Publisher
American Chemical Society
Year
2007
Tongue
English
Weight
147 KB
Volume
111
Category
Article
ISSN
0022-3654

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Dissipative Particle Dynamics Simulation
✍ Sandeep Pal; Christian Seidel 📂 Article 📅 2006 🏛 John Wiley and Sons 🌐 English ⚖ 150 KB

## Abstract **Summary:** The structure of polymer brushes is investigated by dissipative particle dynamics (DPD) simulations that include explicit solvent particles. With an appropriate choice of the DPD interaction parameters $a\_{ij}$, we obtain good agreement with previous molecular dynamics (MD