Publication Date:
2012-03-22
Description:
Author(s): Mark S. Senn, Ingo Loa, Jon P. Wright, and J. Paul Attfield Electronic structure calculations of the Verwey ground state of magnetite, Fe 3 O 4 , using density functional theory with treatment of on-site Coulomb interactions (DFT+U scheme), are reported. These calculations use the recently published experimental crystal structure coordinates for magnetite in the... [Phys. Rev. B 85, 125119] Published Wed Mar 21, 2012
Keywords:
Electronic structure and strongly correlated systems
Print ISSN:
1098-0121
Electronic ISSN:
1095-3795
Topics:
Physics