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American Institute of Physics, Journal of Applied Physics, 17(113), p. 17E108

DOI: 10.1063/1.4793644

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Strain-engineered A-type antiferromagnetic order in YTiO$_3$: a first-principles calculation

Journal article published in 2012 by Xin Huang, Yankun Tang, Shuai Dong
This paper is available in a repository.
This paper is available in a repository.

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Abstract

The epitaxial strain effects on the magnetic ground state of YTiO$_3$ films grown on LaAlO$_3$ substrates have been studied using the first-principles density-functional theory. With the in-plane compressive strain induced by LaAlO$_3$ (001) substrate, A-type antiferromagnetic order emerges against the original ferromagnetic order. This phase transition from ferromagnet to A-type antiferromagnet in YTiO$_3$ film is robust since the energy gain is about 7.64 meV per formula unit despite the Hubbard interaction and modest lattice changes, even though the A-type antiferromagnetic order does not exist in any $R$TiO$_3$ bulks. ; Comment: 3 pages, 2 figures. Proceeding of the 12th Joint MMM/Intermag Conference. Accepted by JAP