Lithium ion transport in a model of amorphous polyethylene oxide

Journal of Computer-Aided Materials Design

Volumn 3, Issue 1-3, 1996, Pages 385-402

  Boinske, P T ^a   Curtiss, L ^b   Halley, J W ^a   Lin, B ^a   Sutjianto, A ^b  

^a University of Minnesota   (United States)

^b ARGONNE NATIONAL LABORATORY   (United States)

Author keywords

Batteries; Lithium; Polyethylene oxide; Transport

Indexed keywords

IONIC CONDUCTION IN SOLIDS; MOLECULAR DYNAMICS; POLYETHYLENE OXIDES; SIMULATION;

LITHIUM ION TRANSPORT;

LITHIUM BATTERIES;

EID: 0030201988     PISSN: 09281045     EISSN: None     Source Type: Journal    
DOI: 10.1007/BF01185677     Document Type: Article

References (19)

1. Armand, M.B., In MacCallum, J.R. and Vincent, C.A. (Eds.) Polymer Electrolyte Reviews, Vol. 1, Elsevier, London, U.K., 1987, pp. 1-22.
2. Ratner, M.A. and Nitzan, A., Faraday Discuss. Chem. Soc., 88 (1989) 19.
3. Druger, S.D., Ratner, M.A. and Nitzan, A., Mol. Cryst. Liq. Cryst., 190 (1990) 171.
4. Hooper, A., Gauthier, M. and Belanger, A., In Linford, R.G. (Ed.) Electrochemical Science and Technology of Polymers, Vol. 2, Elsevier, New York, NY, 1990, pp. 375-411.
5. Vincent, C.A., In Linford, R.G. (Ed.) Electrochemical Science and Technology of Polymers, Vol. 2, Elsevier, New York, NY, 1990, pp. 47-96.
6. Forsyth, M., Payne, V.A., Ratner, M.A., De Leeuw, S.W. and Shriver, D.F., Sol. State Ion., 53-56 (1992) 1011.
7. Xie, L. and Farrington, G.C., Sol. State Ion., 53-56 (1992) 1054.
8. Boden, N., Leng, S.A. and Ward, I.M., Sol. State Ion., 45 (1991) 261.
9. Ratner, M., In MacCallum, J.R. and Vincent, C.A. (Eds.) Polymer Electrolyte Reviews, Vol. 1, Elsevier, London, U.K., 1987, pp. 173-236.
10. Müller-Plathe, F., Liu, H. and Van Gunsteren, W.F., Comput. Polym. Sci., 5 (1995) 89.
11. Berthier, C., Gorecki, W., Minier, M., Armand, M.B., Chabagno, J.B. and Rigaud, P., Sol. State Ion., 11 (1983) 91.
12. Müller-Plathe, F., Acta Polym., 45 (1995) 259.
13. Bennett, C.H., In Nowick, A.S. and Burton, J.J. (Eds.) Diffusion in Solids: Recent Developments, Academic Press, New York, NY, 1975, pp. 73-113.
14. Hehre, W.J., Radom, L., Schleyer, P.v.R. and Pople, J.A., Ab Initio Molecular Orbital Theory, Wiley, New York, NY, 1986.
15. Frisch, M.J., Trucks, G.W., Head-Gordon, M., Gill, P.M.W., Wong, M.W., Foresman, J.B., Johnson, B.G., Schlegel, H.B., Robb, M.A., Replogle, E.S., Gomperts, R., Andres, J.L., Raghavachari, K., Binkley, J.S., Gonzales, C., Martin, R.L., Fox, D.J., Defrees, D.J., Baker, J., Stewart, J.J.P. and Pople, J.A., GAUSSIAN '92, Gaussian Inc., Pittsburgh, PA, 1992.
16. Lin, B., Halley, J.W. and Boinske, P.T., J. Chem. Phys., (1996) in press.
17. Bailey, F.E. and Koleske, J.V., Poly(ethylene oxide), Academic Press, New York, NY, 1976, p. 24.
18. Lin, B. and Halley, J.W., J. Phys. Chem., 99 (1995) 16474.
19. Singh, U.C., Brown, F.K., Brown, P.A. and Kollman, P.A., J. Am. Chem. Soc., 109 (1987) 1608.