Dynamics of liquid sulphur around the equilibrium polymerization transition
✍ Scribed by L. Descôtes; R. Bellissent; P. Pfeuty; A.J. Dianoux
- Publisher
- Elsevier Science
- Year
- 1993
- Tongue
- English
- Weight
- 263 KB
- Volume
- 201
- Category
- Article
- ISSN
- 0378-4371
No coin nor oath required. For personal study only.
✦ Synopsis
Liquid sulphur has been known since the beginning of this century to show at a temperature T, = 160°C a liquid-liquid transition assumed to consist of the polymerization of S, rings into very long polymeric chains. A first neutron scattering study of the liquid local order enabled us to check this assumption at a microscopic level. Then, the vibrational density of states and local motions were studied by time-of-flight (TOF) inelastic neutron scattering as a function of temperature, below and above T,. Both the decrease of the modes characteristic of S, rings and the evolution of the quasielastic scattering with temperature are consistent with the picture of a polymer transition at T, followed by a ring-chain equilibrium.
📜 SIMILAR VOLUMES
Several authors hare developed alternative treatments of the polymeriz&ion equilibrium. Each of these methods has its own specific drawbacks. By ohoice,of suitable reactions in describing the polymerization equilibrium, and by introduction of the Flory parameter @) these drawbacks have been eliminat
A numerical rxlculation based on the molecular dynamics method is described and the dynamical chaacteristics oi the interracial layer between the liquid and solid phases are studied. Special initial and boundary conditions have been used. The chmxcterirtic vibrations and the anisotropy
Molecular dynamics simulations were performed for eight different metals to calculate their constant volume heat capacity and latent heat in both liquid and solid phases. The atomic interaction for the simulations is taken as modeled by the n-body semi-empirical Gupta potential. The per atom energie