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We used Raman scattering to study the lattice and magnetic excitations in the hexagonal HoMnO3 single crystals. The E2 phonon mode at 237 cm-1 is affected by the magnetic order. This mode is related to the displacement of Mn and O ions in…

Strongly Correlated Electrons · Physics 2018-10-17 J. Liu , Y. Gallais , M-A. Measson , A. Sacuto , S. W. Cheong , M. Cazayous

We use density-functional theory calculations to explore the magnetic properties of perovskite rare-earth nickelates, $\mathcal{R}$NiO$_3$, by constructing microscopic magnetic models containing all relevant exchange interactions via…

Materials Science · Physics 2021-08-04 Danis I. Badrtdinov , Alexander Hampel , Cyrus E. Dreyer

We report a study of magnetic dynamics in multiferroic hexagonal manganite HoMnO3 by far-infrared spectroscopy. Low-temperature magnetic excitation spectrum of HoMnO3 consists of magnetic-dipole transitions of Ho ions within the…

Materials Science · Physics 2009-11-13 D. Talbayev , A. D. LaForge , S. A. Trugman , N. Hur , A. J. Taylor , R. D. Averitt , D. N. Basov

We present a systematic density functional theory (DFT) plus Hubbard $U$ study of structural trends and the stability of different magnetically ordered states across the rare-earth nickelate series, $R$NiO$_3$, with $R$ from Lu to La. In…

Materials Science · Physics 2017-10-17 Alexander Hampel , Claude Ederer

The interplay of lattice, electronic, and spin degrees of freedom at epitaxial complex oxide interfaces provides a route to tune their magnetic ground states. Unraveling the competing contributions is critical for tuning their functional…

Materials Science · Physics 2024-03-07 Xuanyi Zhang , Athby Al-Tawhid , Padraic Schafer , Zhan Zhang , Divine P. Kumah

The aim of this work is to unravel a basic microscopic picture behind complex magnetic properties of hexagonal manganites. For these purposes, we consider two characteristic compounds: YMnO3 and LuMnO3, which form different magnetic…

Materials Science · Physics 2012-08-10 I. V. Solovyev , M. V. Valentyuk , V. V. Mazurenko

The effect of uniaxial strain on electronic structure and magnetism in LaMnO$_3$ is studied from a model Hamiltonian that illustrates the competition between the Jahn-Teller, super exchange, and double exchange interactions. We retain in…

Materials Science · Physics 2010-12-07 B. R. K. Nanda , S. Satpathy

We report a high-pressure study of orthorhombic rare-earth manganites AMnO3 using Raman scattering (for A = Pr, Nd, Sm, Eu, Tb and Dy) and synchrotron X-ray diffraction (for A = Pr, Sm, Eu, and Dy). In all cases, a structural and…

Multiferroic rare earth manganites attracted recent attention because of the coexistence of different types of magnetic and ferroelectric orders resulting in complex phase diagrams and a wealth of physical phenomena. The coupling and mutual…

Strongly Correlated Electrons · Physics 2007-05-23 B. Lorenz , C. R. dela Cruz , F. Yen , Y. Q. Wang , Y. Y. Sun , C. W. Chu

We calculate the structural, electronic, and magnetic properties of MnO from first principles, using the full-potential linearized augmented planewave method, with both local-density and generalized-gradient approximations to exchange and…

Condensed Matter · Physics 2009-10-31 J. E. Pask , D. J. Singh , I. I. Mazin , C. S. Hellberg , J. Kortus

Magnetic order of the manganese and rare-earth lattices according to different symmetry representations is observed in multiferroic hexagonal (h-) DyMnO$_3$ by optical second harmonic generation and neutron diffraction. The incompatibility…

Strongly Correlated Electrons · Physics 2012-08-08 C. Wehrenfennig , D. Meier , Th. Lottermoser , Th. Lonkai , J. -U. Hoffmann , N. Aliouane , D. N. Argyriou , M. Fiebig

We study how strain affects orbital ordering and magnetism at the interface between SrMnO$_3$ and LaMnO$_3$ from density-functional calculations and interpret the basic results in terms of a three-site Mn-O-Mn model. Magnetic interaction…

Materials Science · Physics 2010-03-10 B. R. K. Nanda , S. Satpathy

The magnetic phases of hexagonal perovskites RMnO_3 (R=Ho, Er, Tm, Yb, Sc, Y) are analysed using group theory and the Landau theory of phase transitions. The competition between various magnetic order parameters is discussed in the context…

Other Condensed Matter · Physics 2007-05-23 I. Munawar , S. H. Curnoe

We use ab initio electronic structure calculations within the generalized gradient approximation (GGA+U) to density functional theory (DFT) to determine the microscopic exchange interactions in the series of orthorhombic rare-earth…

Materials Science · Physics 2015-04-22 Natalya S. Fedorova , Claude Ederer , Nicola A. Spaldin , Andrea Scaramucci

We use resonant and non-resonant X-ray diffraction measurements in combination with first-principles electronic structure calculations and Monte Carlo simulations to study the relationship between crystal structure and multiferroic orders…

Density functional theory is used to investigate the effect of biaxial strain on the structural, electronic and magnetic properties of [111]-oriented NdNiO$_3$, as a representative of the rare-earth perovskites that undergo…

Materials Science · Physics 2025-07-29 Alexander Lione , Jorge Íñiguez-González , Nicholas C. Bristowe

We have synthesized epitaxial La(1-x)Sr(1+x)MnO4 (x=1/3) films as random alloys and cation-ordered analogues to probe how cation order affects the properties of a 2D manganite. The films show weak ferromagnetic ordering up to 130 K,…

Strongly Correlated Electrons · Physics 2015-05-20 B. B. Nelson-Cheeseman , A. B. Shah , T. S. Santos , S. D. Bader , J. -M. Zuo , A. Bhattacharya

InMnO$_3$ is a peculiar member of the hexagonal manganites h-RMnO$_3$ (where R is a rare earth metal element), showing crystalline, electronic and magnetic properties at variance with the other compounds of the family. We have studied high…

Materials Science · Physics 2015-03-19 X. Fabrèges , I. Mirebeau , S. Petit , P. Bonville , A. A. Belik

Symmetry arguments are used to develop a spin Hamiltonian for the description of the complex magnetic ordering in HoMnO$_3$. Using a novel application of the Landau Lifshitz Gilbert dynamic torque equations to this model of the frustrated…

Strongly Correlated Electrons · Physics 2012-02-13 S. G. Condran , M. L. Plumer

We review some aspects related to orbital degrees of freedom in manganites. The Mn$^{3+}$ ions in these compounds have double orbital degeneracy and are strong Jahn-Teller ions, causing structural distortions and orbital ordering. We…

Strongly Correlated Electrons · Physics 2007-05-23 Jeroen van den Brink , Giniyat Khaliullin , Daniel Khomskii
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