First principles calculations of doped MnBi compounds

<p>We investigate the effect of the substitution of Ni, Ti and Co in MnBi using first principles calculations based on density functional theory (DFT) within the generalized gradient approximation (GGA). We also performed total energy calculations to compare different structures to determine t...

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Bibliographic Details
Main Author: Ababtin, Sultana Abdullah
Other Authors: R. Torsten Clay
Format: Others
Language:en
Published: MSSTATE 2015
Subjects:
Online Access:http://sun.library.msstate.edu/ETD-db/theses/available/etd-03252015-145832/