Structure and dynamics of metal clusters

<p>This thesis is concerned with the development of <em>ab-initio</em> molecular dynamics (AIMD) using density functional theory, and its application to simple diatomics and small sodium clusters. The approach follows Car and Parrinello and the local spin density (LSD) approximati...

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Bibliographic Details
Main Author: Penman, J
Other Authors: Madden, P
Format: Thesis
Language:English
Published: 1992
Subjects: