Ab Initio Theory of Thermal Spin-Lattice Disorder in Iron and Invar:

Thesis advisor: David Broido === Despite its deceptive simplicity and because of its scientific and technological importance, bcc Fe is still the subject of research and debate. We develop an ab initio theoretical framework and apply it to calculate temperature-dependent phonon modes and magnetic in...

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Bibliographic Details
Main Author: Heine, Matthew
Format: Others
Language:English
Published: Boston College 2020
Subjects:
Online Access:http://hdl.handle.net/2345/bc-ir:108985