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• W3021947507 endingPage "034007" @default.
• W3021947507 startingPage "034007" @default.
• W3021947507 abstract "Abstract We study a coarse-grained model for a binary blend system composed of cis-polyisoprene and vinyl-polybutadiene. Since the slow relaxation dynamics of polymers may require very long simulation times, coarse-grained descriptions are regularly used in order to reduce computational cost while keeping the essential physics. Relaxation dynamics of a coarse-grained model is sometimes accelerated by the smooth coarse-grained potentials. However, the magnitude of the acceleration may be different in different components in a multi-component system. In order to simulate a time-scale consistent dynamics, the acceleration effects should be the same across the different components. Here, we investigate a time-scale consistent coarse-grained model for a binary polymer blend. For the coarse-grained equation of motion, we adopt the Langevin equation and adjust the friction coefficients by focusing on the relaxation times of the first normal mode of the polymers. A united-atom model is used as a reference system of the coarse-graining. Since it is found that the solubility parameter of the atomistic model is much larger than the experimental result, our simulation model is not applicable for the quantitative predictions, but we utilize it as a example system to study a time scale mismatch of a coarse-grained model. We find that the coarse-grained potentials and the friction coefficients derived for one blend composition captures different compositions of the blend. Furthermore, it is found that the magnitude of the acceleration effects of the blend rarely depends on the composition ratio. This implies that our coarse-grained model can be used for inhomogeneous systems." @default.
• W3021947507 created "2020-05-13" @default.
• W3021947507 creator A5003696192 @default.
• W3021947507 creator A5078466092 @default.
• W3021947507 date "2020-06-01" @default.
• W3021947507 modified "2023-09-27" @default.
• W3021947507 title "A composition transferable and time-scale consistent coarse-grained model for cis-polyisoprene and vinyl-polybutadiene oligomeric blends" @default.
• W3021947507 cites W1911693620 @default.
• W3021947507 cites W1965362941 @default.
• W3021947507 cites W1965459424 @default.
• W3021947507 cites W1966743690 @default.
• W3021947507 cites W1969367867 @default.
• W3021947507 cites W1971813690 @default.
• W3021947507 cites W1974771740 @default.
• W3021947507 cites W1980266252 @default.
• W3021947507 cites W1980883822 @default.
• W3021947507 cites W1981516987 @default.
• W3021947507 cites W1992504906 @default.
• W3021947507 cites W1998795262 @default.
• W3021947507 cites W2000045761 @default.
• W3021947507 cites W2002480191 @default.
• W3021947507 cites W2002530725 @default.
• W3021947507 cites W2004369921 @default.
• W3021947507 cites W2005347566 @default.
• W3021947507 cites W2010881322 @default.
• W3021947507 cites W2017196167 @default.
• W3021947507 cites W2017918436 @default.
• W3021947507 cites W2019465613 @default.
• W3021947507 cites W2021442911 @default.
• W3021947507 cites W2030031827 @default.
• W3021947507 cites W2030891958 @default.
• W3021947507 cites W2033963754 @default.
• W3021947507 cites W2037905990 @default.
• W3021947507 cites W2039529522 @default.
• W3021947507 cites W2040718790 @default.
• W3021947507 cites W2043244472 @default.
• W3021947507 cites W2048754774 @default.
• W3021947507 cites W2049286183 @default.
• W3021947507 cites W2050607486 @default.
• W3021947507 cites W2052885516 @default.
• W3021947507 cites W2053128374 @default.
• W3021947507 cites W2053640460 @default.
• W3021947507 cites W2056566080 @default.
• W3021947507 cites W2061308254 @default.
• W3021947507 cites W2070210194 @default.
• W3021947507 cites W2071618903 @default.
• W3021947507 cites W2071788034 @default.
• W3021947507 cites W2072413457 @default.
• W3021947507 cites W2074908327 @default.
• W3021947507 cites W2081693079 @default.
• W3021947507 cites W2082627391 @default.
• W3021947507 cites W2083590256 @default.
• W3021947507 cites W2084042727 @default.
• W3021947507 cites W2085213650 @default.
• W3021947507 cites W2085756957 @default.
• W3021947507 cites W2085775782 @default.
• W3021947507 cites W2086903738 @default.
• W3021947507 cites W2087876713 @default.
• W3021947507 cites W2090482308 @default.
• W3021947507 cites W2093310284 @default.
• W3021947507 cites W2095403618 @default.
• W3021947507 cites W2098338793 @default.
• W3021947507 cites W2103501660 @default.
• W3021947507 cites W2124138287 @default.
• W3021947507 cites W2127095150 @default.
• W3021947507 cites W2130149585 @default.
• W3021947507 cites W2131866773 @default.
• W3021947507 cites W2157242092 @default.
• W3021947507 cites W2167736585 @default.
• W3021947507 cites W2168975594 @default.
• W3021947507 cites W2240092441 @default.
• W3021947507 cites W2256437026 @default.
• W3021947507 cites W2261031917 @default.
• W3021947507 cites W2276531496 @default.
• W3021947507 cites W2319567137 @default.
• W3021947507 cites W2324861489 @default.
• W3021947507 cites W2334045600 @default.
• W3021947507 cites W2400951690 @default.
• W3021947507 cites W2467323641 @default.
• W3021947507 cites W2485658318 @default.
• W3021947507 cites W2539031939 @default.
• W3021947507 cites W2567718390 @default.
• W3021947507 cites W2570438134 @default.
• W3021947507 cites W2572638792 @default.
• W3021947507 cites W2591370893 @default.
• W3021947507 cites W2616074318 @default.
• W3021947507 cites W2763252772 @default.
• W3021947507 cites W2775995787 @default.
• W3021947507 cites W2803084021 @default.
• W3021947507 cites W2826223721 @default.
• W3021947507 cites W2908239103 @default.
• W3021947507 cites W2917751535 @default.
• W3021947507 cites W2925941894 @default.
• W3021947507 cites W2969431620 @default.
• W3021947507 cites W2972815697 @default.
• W3021947507 cites W2981056943 @default.
• W3021947507 cites W3004234646 @default.
• W3021947507 cites W3098631722 @default.

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