Computer simulations of energetic and conformational changes in polymer systems

Kreitmeier, Stefan and Wittkop, Markus and Göritz, Dietmar (1995) Computer simulations of energetic and conformational changes in polymer systems. MACROMOLECULAR SYMPOSIA, 100 (1). pp. 181-185. ISSN 1022-1360

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Abstract

Using a Monte Carlo method, the deformation behavior of single polymer coils was investigated. Random walks were used to verify the stretching procedure. The prediction of Pincus and DeGennes for self avoiding walks could be confirmed. The simulations at finite temperatures showed a transition from entropy to energy controlled behavior. The coils underwent a clear nonaffine deformation pattern.

Item Type: Article
Uncontrolled Keywords: BOND FLUCTUATION METHOD; LONG-CHAIN MOLECULES; MONTE-CARLO; TRANSITION; DYNAMICS; MODEL
Subjects: 500 Science > 530 Physics
Divisions: Physics > Institute of Experimental and Applied Physics > Alumni or Retired Professors > Group Dietmar Göritz
Depositing User: Dr. Gernot Deinzer
Date Deposited: 17 Nov 2023 12:21
Last Modified: 17 Nov 2023 12:21
URI: https://pred.uni-regensburg.de/id/eprint/52295

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