Abstract
An extended test-particle method is used to predict the inter- and intramolecular correlation functions of freely jointed hard-sphere- Yukawa-chain fluids by calculating the segmental density distributions around a fixed segment. The underlying density functional theory for chain fluids is based on a modified fundamental measure theory for the hard-sphere repulsive and a mean-field approximation for attraction between different segments. The calculated intra- and inter-molecular distribution functions agree well with the results from Monte Carlo simulations, better than those from alternative approaches.
Original language | English (US) |
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Pages (from-to) | 246-249 |
Number of pages | 4 |
Journal | Chinese Physics Letters |
Volume | 22 |
Issue number | 1 |
DOIs | |
State | Published - Jan 2005 |
ASJC Scopus subject areas
- General Physics and Astronomy