Theoretical prediction of the specific heat of polymer glasses
作者:
E. A. DiMarzio,
F. Dowell,
期刊:
Journal of Applied Physics
(AIP Available online 1979)
卷期:
Volume 50,
issue 10
页码: 6061-6066
ISSN:0021-8979
年代: 1979
DOI:10.1063/1.325794
出版商: AIP
数据来源: AIP
摘要:
Lattice vibrations are incorporated into the Gibbs‐DiMarzio configurational entropy theory of glasses. A comparison is made with data compiled by O’Reilly. The resulting theory predicts the specific‐heat discontinuity at the glass transition to within 20%. No adjustable parameters are involved; only the chemical structure need be known. The specific‐heat discontinuity has three parts. The formula in customary notation is &Dgr;cp=R(&Dgr;&egr;/kTg)2 f(1−f) +RTg&Dgr;&agr; (4−Tg&Dgr;&agr;/0.06) +0.5Tg&Dgr;&agr;cp(Tg−). The first part is a configurational term arising from shape changes of the molecules (?50% of total). The second part is a configurational term arising from volume expansion (?30% of total). Finally there is a vibrational contribution arising from the change of the force constants (or characteristics frequencies) with temperature (?20% of total).
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