Simulation of interdiffusion in between compartments having heterogeneously distributed donors and accepters

Citation
E. Tuzel et al., Simulation of interdiffusion in between compartments having heterogeneously distributed donors and accepters, POLYMER, 41(20), 2000, pp. 7539-7546
Citations number
25
Categorie Soggetti
Organic Chemistry/Polymer Science
Journal title
POLYMER
ISSN journal
00323861 → ACNP
Volume
41
Issue
20
Year of publication
2000
Pages
7539 - 7546
Database
ISI
SICI code
0032-3861(200009)41:20<7539:SOIIBC>2.0.ZU;2-7
Abstract
The final stage of latex film formation was simulated by introducing donors and accepters into the adjacent compartments of a cube. Homogeneous and/or heterogeneous donor-acceptor distributions were chosen for different types of simulations. The interdiffusion of the donors and the accepters within these cubes was generated using the Monte-Carlo technique. The decay of the donor intensity I(t) by direct energy transfer (DET) was simulated for sev eral interdiffusion steps. Gaussian noise was added to the I(t) curves to o btain more realistic decay profiles. I(t) decay curves were fitted to the p henomenological equation to calculate the fractional mixing at each interdi ffusion step. The reliability of the Fickian diffusion model in the case of heterogeneous and homogeneous donor-acceptor distributions are discussed f or latex film formation. (C) 2000 Elsevier Science Ltd. Ail rights reserved .