Chain length dependence of the state diagram of a single stiff-chain macromolecule: Theory and Monte Carlo simulation

M. R. Stukan; V. A. Ivanov; A. Yu Grosberg; W. Paul; K. Binder

doi:10.1063/1.1536620

Chain length dependence of the state diagram of a single stiff-chain macromolecule: Theory and Monte Carlo simulation

M. R. Stukan, V. A. Ivanov, A. Yu Grosberg, W. Paul, K. Binder

Research output: Contribution to journal › Article › peer-review

Abstract

The chain length dependence of the size of a toroidal globule and the shift of transition lines in the coil-globule state diagram for single stiff-chain macromolecules of different chain length was analyzed. The investigation was performed using a mean field theoretical approach and Monte Carlo computer simulations. The theoretical and computer simulation results for phase diagram and toroidal size showed reasonable agreement.

Original language	English (US)
Pages (from-to)	3392-3400
Number of pages	9
Journal	Journal of Chemical Physics
Volume	118
Issue number	7
DOIs	https://doi.org/10.1063/1.1536620
State	Published - Feb 15 2003

ASJC Scopus subject areas

General Physics and Astronomy
Physical and Theoretical Chemistry

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abstract = "The chain length dependence of the size of a toroidal globule and the shift of transition lines in the coil-globule state diagram for single stiff-chain macromolecules of different chain length was analyzed. The investigation was performed using a mean field theoretical approach and Monte Carlo computer simulations. The theoretical and computer simulation results for phase diagram and toroidal size showed reasonable agreement.",

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AU - Grosberg, A. Yu

AU - Paul, W.

AU - Binder, K.

PY - 2003/2/15

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N2 - The chain length dependence of the size of a toroidal globule and the shift of transition lines in the coil-globule state diagram for single stiff-chain macromolecules of different chain length was analyzed. The investigation was performed using a mean field theoretical approach and Monte Carlo computer simulations. The theoretical and computer simulation results for phase diagram and toroidal size showed reasonable agreement.

AB - The chain length dependence of the size of a toroidal globule and the shift of transition lines in the coil-globule state diagram for single stiff-chain macromolecules of different chain length was analyzed. The investigation was performed using a mean field theoretical approach and Monte Carlo computer simulations. The theoretical and computer simulation results for phase diagram and toroidal size showed reasonable agreement.

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Chain length dependence of the state diagram of a single stiff-chain macromolecule: Theory and Monte Carlo simulation

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