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1 Smith, Grant D.Molecular dynamics of a 1,4-polybutadiene melt. Comparison of experiment and simulationWe have made detailed comparison of the local and chain dynamics of a melt of 1,4-polybutadiene (PBD) as determined from experiment and molecular dynamics simulation at 353 K. The PBD was found to have a random microstructure consisting of 40% cis, 50% trans, and 10% 1,2-vinyl units with a number-av...Polybutadiene melt; Molecular dynamics1999
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