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Solid-liquid coexistence in ionic systems and the properties of the interface

Abstract:

The crystal-melt interfaces of pure KCl and LiCl crystals with (Li,K)Cl melts of various compositions have been investigated by direct simulation of coexisting crystalline and molten regions. This system forms no solid compounds involving both lithium and potassium and exhibits a eutectic close to the equimolar composition. Simulations at various melt compositions allow the liquidus to be determined and compared with experiment. In order to test the precision achievable by a direct simulation...

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Publication status:
Published

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Institution:
University of Oxford
Division:
MPLS
Department:
Materials
Role:
Author
Journal:
MOLECULAR PHYSICS
Volume:
102
Issue:
9-10
Pages:
839-855
Publication date:
2004-05-10
DOI:
EISSN:
1362-3028
ISSN:
0026-8976
Language:
English
Pubs id:
pubs:369766
UUID:
uuid:61e3d77c-9228-45fa-aeaa-6b2ff09db10e
Local pid:
pubs:369766
Source identifiers:
369766
Deposit date:
2013-11-16

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