𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Molecular mechanics and dynamics simulation of poly (ethylene oxide) electrolytes

✍ Scribed by L. Xie; G.C. Farrington


Publisher
Elsevier Science
Year
1992
Tongue
English
Weight
341 KB
Volume
53-56
Category
Article
ISSN
0167-2738

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Molecular dynamics simulation of the cry
✍ Sylvie Neyertz; David Brown; John O. Thomas πŸ“‚ Article πŸ“… 1995 πŸ› Elsevier Science 🌐 English βš– 712 KB

The polymer-polymer interaction potential used in an earlier reported MD simulation of crystalline PEO [Neyertz, Brown and Thomas, J. Chem. Phys., 101, 10064 (1994)] is here transferred to the crystalline phase of poly(ethylene oxide)-sodium iodide, PEO,NaI. An appropriate set of ion-ion and ion-po

Ab initio quantum chemistry and molecula
✍ Oleg Borodin; Grant D. Smith; Richard L. Jaffe πŸ“‚ Article πŸ“… 2001 πŸ› John Wiley and Sons 🌐 English βš– 264 KB πŸ‘ 1 views

## Abstract __Ab initio__ and molecular mechanics studies of LiPF~6~ and the interaction of the salt with the poly(ethylene oxide) (PEO) oligomer dimethylether have been performed. Optimized geometries and energies of Li^+^/PF~6~^βˆ’^ complexes obtained from quantum chemistry revealed a preference fo

Molecular composites of poly(p-phenylene
✍ L. Tsou; J. A. Sauer; M. Hara πŸ“‚ Article πŸ“… 2000 πŸ› John Wiley and Sons 🌐 English βš– 339 KB πŸ‘ 2 views

Molecular composites were prepared by the solution blending of poly(ethylene oxide) (PEO) of three different molecular weights with low concentrations of poly(p-phenylene terephthalamide) (PPTA) anion serving as a rigid-rod reinforcement. For all of the composites, the tensile strength, stiffness, a