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Chemical Structure and Local Segmental Dynamics in 1,2-Polybutadiene

✍ Scribed by Roland, C. M.; Casalini, R.; Santangelo, P.; Sekula, M.; Ziolo, J.; Paluch, M.

Book ID
125973073
Publisher
American Chemical Society
Year
2003
Tongue
English
Weight
116 KB
Volume
36
Category
Article
ISSN
0024-9297

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## Abstract Summary: We present results for the temperature and pressure dependence of local structure and chain packing in __cis__‐1,4‐polybutadiene (__cis__‐1,4‐PB) from detailed molecular dynamics (MD) simulations with a united‐atom model. The simulations have been executed in the NPT statistica