A Modern Approach to the Solution and Analysis of the Simha-Somcynsky Model for the Description of Pressure-Volume-Temperature Properties of Polymer Fluids
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A Modern Approach to the Solution and Analysis of the Simha-Somcynsky Model for the Description of Pressure-Volume-Temperature Properties of Polymer Fluids
A Modern Approach to the Solution and Analysis of the Simha-Somcynsky Model for the Description of Pressure-Volume-Temperature Properties of Polymer Fluids
Chinese Journal of Polymer Science2015年33卷第4期 页码:523-539
Affiliations:
Department of Polymer Science, College of Polymer Science and Polymer Engineering, The University of Akron, Akron, OH 44325-3909, USA
Author bio:
*Gustavo A. Carri, E-mail: gustavo.carri@gmail.com
Gustavo A. Carri. A Modern Approach to the Solution and Analysis of the Simha-Somcynsky Model for the Description of Pressure-Volume-Temperature Properties of Polymer Fluids[J]. Chinese Journal of Polymer Science, 2015,33(4):523-539.
Gustavo A. Carri. A Modern Approach to the Solution and Analysis of the Simha-Somcynsky Model for the Description of Pressure-Volume-Temperature Properties of Polymer Fluids[J]. Chinese Journal of Polymer Science, 2015, 33(4): 523-539.
Gustavo A. Carri. A Modern Approach to the Solution and Analysis of the Simha-Somcynsky Model for the Description of Pressure-Volume-Temperature Properties of Polymer Fluids[J]. Chinese Journal of Polymer Science, 2015,33(4):523-539.DOI: 10.1007/s10118-015-1601-7.
Gustavo A. Carri. A Modern Approach to the Solution and Analysis of the Simha-Somcynsky Model for the Description of Pressure-Volume-Temperature Properties of Polymer Fluids[J]. Chinese Journal of Polymer Science, 2015, 33(4): 523-539.DOI: 10.1007/s10118-015-1601-7.
A Modern Approach to the Solution and Analysis of the Simha-Somcynsky Model for the Description of Pressure-Volume-Temperature Properties of Polymer Fluids
We revisit the Simha-Somcynsky model of polymer fluids with the purpose of developing novel theoretical and computational approaches to simplify and speed up its solution as well as the fitting of experimental data
and decrease its level of mathematical complexity. We report a novel method that allows us to solve one of the two equations of the model exactly
thus putting the level of mathematical difficulty on a par with the one of other models for polymer fluids. Moreover
we describe a computational algorithm capable of fitting all five parameters of the model in an unbiased way. The results obtained reproduce literature results and fit experimental pressure-volume-temperature and solubility parameter data for three polymers very accurately. Moreover
the new techniques allow for the investigation of the model at very low temperatures. Unexpectedly
the model predicts behaviors that could be interpreted as a glass transition
as routinely observed in dilatometry and differential scanning calorimetry
and a glass phase. We compared the predicted and experimental
T
g
’s for
cis
poly(1
4-butadiene) and found an excellent quantitative agreement.
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