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MOLECULAR-DYNAMICS SIMULATION OF THE CRYSTALLINE PHASE OF POLY(ETHYLENE OXIDE)-SODIUM IODIDE, PEO(3)NAI
Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Chemistry, Department of Materials Chemistry. Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Chemistry, Department of Materials Chemistry, Structural Chemistry. strukturkemi.
1995 (English)In: ELECTROCHIMICA ACTA, Vol. 40, no 13-14, p. 2063-2069Article in journal (Refereed) Published
Abstract [en]

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(
Place, publisher, year, edition, pages
1995. Vol. 40, no 13-14, p. 2063-2069
Keywords [en]
MOLECULAR DYNAMICS; SIMULATION; POLY(ETHYLENE OXIDE); SODIUM IODIDE; CRYSTAL STRUCTURE; MOLTEN NAI; COMPLEX; OXIDE)
National Category
Inorganic Chemistry
Identifiers
URN: urn:nbn:se:uu:diva-68626OAI: oai:DiVA.org:uu-68626DiVA, id: diva2:96537
Note
Addresses: NEYERTZ S, UNIV MANCHESTER, INST SCI & TECHNOL, DEPT CHEM, MANCHESTER M60 1QD, LANCS, ENGLAND. UNIV UPPSALA, Dept of Materials Chemistry, Box 538 S-75121 UPPSALA, SWEDEN.Available from: 2006-10-03 Created: 2006-10-03 Last updated: 2011-01-16

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Thomas, John

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