𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Force Field Development and MD Simulations of Poly(ethylene oxide)/LiBF 4 Polymer Electrolytes

✍ Scribed by Borodin, Oleg; Smith, Grant D.; Douglas, Richard

Book ID
118062402
Publisher
American Chemical Society
Year
2003
Tongue
English
Weight
247 KB
Volume
107
Category
Article
ISSN
0022-3654

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Computer simulations of poly(ethylene ox
Computer simulations of poly(ethylene oxide): force field, pvt diagram and cyclization behaviour
✍ Rigby, David; Sun, Huai; Eichinger, B. E. πŸ“‚ Article πŸ“… 1997 πŸ› John Wiley and Sons 🌐 English βš– 413 KB

Parametrization of a force Ðeld capable of quantitatively describing the gas, liquid and crystal phases of alcohols, ethers and polyethers is described. Two applications are reported, the Ðrst employing atomistic simulations to study PVT (pressure, volume, temperature) and cohesive properties of oli