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Ionic Overlayers on Corrugated Surfaces I: Structure

Published online by Cambridge University Press:  01 January 1992

Tahir Çağin,
Surajit Sen,
Hyangsuk Seong and
S.D. Mahanti
Tahir Çağin
Affiliation:
Molecular Simulations Inc., Suite 540, 199 S Robles Av., Pasadena, CA 91101
Surajit Sen
Affiliation:
Department of Physics and Astronomy and the Center for Fundamental Materials Research, Michigan State University, East Lansing, MI 48824
Hyangsuk Seong
Affiliation:
Department of Physics and Astronomy and the Center for Fundamental Materials Research, Michigan State University, East Lansing, MI 48824
S.D. Mahanti
Affiliation:
Department of Physics and Astronomy and the Center for Fundamental Materials Research, Michigan State University, East Lansing, MI 48824
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Abstract

Structural and dynamic properties of a large class of intercalation compounds can be modelled by a collection of ions interacting via a screened Coulomb potential and subjected to the corrugation potential produced by the host atoms. In this paper we discuss the results of Molecular Dynamics simulation studies of the ground state structure of RbC 24 and related systems focussing primarily on the micro-structure i.e.on the nature of the domains and domain walls.

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Type
Research Article
Information
MRS Online Proceedings Library (OPL) , Volume 291: Symposium O – Materials Theory and Modeling , 1992, 233
Copyright
Copyright © Materials Research Society 1993

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References

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