Abstract
The site-density integral equation (SDIE) for polymer liquids under an arbitrary external field was derived by the density-functional theory (DFT). The ideal chain gas was employed in order to make the DFT computationally tractable. Thus, many-body effects were considered through an effective external field acting on the ideal chain gas. The effectivie external field was described by the site-density expansion of the excess intrinsic chemical potential from the ideal chain gas up to the first order.
Original language | English |
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Pages (from-to) | 2431-2442 |
Number of pages | 12 |
Journal | Journal of Chemical Physics |
Volume | 118 |
Issue number | 5 |
DOIs | |
Publication status | Published - Feb 1 2003 |
Externally published | Yes |
ASJC Scopus subject areas
- Physics and Astronomy(all)
- Physical and Theoretical Chemistry