A molecular dynamics investigation of the structure of PbO---PbF2 glasses*1

Damodaran, KV and Rao, KJ (1988) A molecular dynamics investigation of the structure of PbO---PbF2 glasses*1. In: Chemical Physics Letters, 148 (1). pp. 57-61.

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Abstract

The structure of PbO---PbF2 glasses has been studied using molecular dynamics (MD). The existence of [OPb4] structural units is observed over the entire glass-forming range, in conformity with a model proposed earlier based on various structural investigations of this system. Various other features of the structural model are also supported by the MD calculations.

Item Type:	Journal Article
Publication:	Chemical Physics Letters
Publisher:	Elsevier Science
Additional Information:	Copy rights of this article belongs to Elsevier Science Ltd.
Department/Centre:	Division of Chemical Sciences > Solid State & Structural Chemistry Unit
Date Deposited:	01 Feb 2010 07:11
Last Modified:	19 Sep 2010 05:39
URI:	http://eprints.iisc.ac.in/id/eprint/21958

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