Computer simulation of ionically conducting polymers
โ Scribed by C.R.A. Catlow; G.E. Mills
- Publisher
- Elsevier Science
- Year
- 1995
- Tongue
- English
- Weight
- 450 KB
- Volume
- 40
- Category
- Article
- ISSN
- 0013-4686
No coin nor oath required. For personal study only.
โฆ Synopsis
We investigate the structural and dynamic properties of the NaI/PEO polymer electrolyte systems using molecular dynamics simulation techniques. Our simulations, which are performed as a function of both temperature and salt concentration, emphasise the role of ionic association in these materials. The diffusion coefftcients calculated for both Naf and I-are in reasonable agreement with experiment.
๐ SIMILAR VOLUMES
The theory of dynamic systems was used for a simulation of the transition between branched and network macromolecular structures. The system of difference equations was proposed as a corresponding model. The dependence of the limit fraction of crosslinked units on the values of equation coefficients
A discrete computer model simulating the operation of the cardiac impulse transmission apparatus and the electropotential changes of the heart musculature has been developed on a NORD-100 minicomputer. The model is written in NORD-FORTRAN and allows description of practically all basic pathologies o