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A computer simulation study of beta-spodumene

Morrison, Glenn, Barker, Carolyn M., Kennedy, K.M., Chadwick, Alan V. (1996) A computer simulation study of beta-spodumene. Materials Science Forum, 239 . pp. 417-420. ISSN 0255-5476. (doi:10.4028/www.scientific.net/MSF.239-241.417) (The full text of this publication is not currently available from this repository. You may be able to access a copy if URLs are provided)

The full text of this publication is not currently available from this repository. You may be able to access a copy if URLs are provided. (Contact us about this Publication)
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http://dx.doi.org/10.4028/www.scientific.net/MSF.2...

Abstract

Atomistic computer modelling has been applied to the strucure of beta-Spodumene(LiAlSi2O6). A general Li - O potential has been derived for use with this and other lithium aluminium silicates. The results are reported here. Defect calculations have been used to study the Li+ ion migration through this structure.

Item Type: Article
DOI/Identification number: 10.4028/www.scientific.net/MSF.239-241.417
Additional information: Conference Information: 13th International Conference on Defects in Insulating Materials (ICDIM 96) Wake Forest Univ, Winston Salem, NC, Jul 15-19, 1996 AMP Inc; Hughes Res Labs; Int Sci Fdn; Natl Sci Fdn; Newport; Wake Forest Univ
Uncontrolled keywords: spodumene; LiAlSi2O6; ion migration; computer modelling
Subjects: Q Science
Q Science > QD Chemistry
Divisions: Faculties > Sciences > School of Physical Sciences
Depositing User: M.A. Ziai
Date Deposited: 29 Jun 2011 08:46 UTC
Last Modified: 05 Jun 2019 08:14 UTC
Resource URI: https://kar.kent.ac.uk/id/eprint/18202 (The current URI for this page, for reference purposes)
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