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Since its original prediction 25 years ago, room-temperature out-of-plane ferroelectricity in compressively strained SrTiO3 remains an ongoing pursuit. In this work, we investigate the structural, electrical and electromechanical properties…

We investigate the role of electric toroidal dipoles in the prototypical ferroaxial materials NiTiO$_3$ and K$_2$Zr(PO$_4$)$_2$, which undergo ferroaxial structural phase transitions of order-disorder and displacive type, respectively.…

Materials Science · Physics 2024-07-12 Sayantika Bhowal , Nicola A. Spaldin

A thermodynamic theory is developed for dense laminar domain structures in epitaxial ferrolectric films. It is found that, at some critical misfit strain between the film and substrate, the 90 degrees c/a/c/a domain structure becomes…

Materials Science · Physics 2009-10-31 N. A. Pertsev , V. G. Koukhar

Strontium titanate is an incipient ferroelectric in which superconductivity emerges at exceptionally low doping levels. Remarkably, stabilizing the polar phase through strain or chemical substitution has been shown to significantly enhance…

Materials Science · Physics 2022-12-15 Alex Hallett , John W. Harter

Nanometer-scale modulations can spontaneously emerge in complex materials when multiple degrees of freedom interact. Here we demonstrate that ferroelectric Sr$_{1-x}$Ca$_x$TiO$_3$ lies in close proximity to an incipient structurally…

We describe length and time rescaling across the paraelectric to ferroelectric phase transition in BaTiO$_3$. Small ferroelectric clusters are unable to grow in the paraelectric phase and exist for a short period of time only. The onset of…

Materials Science · Physics 2009-01-30 Marek Pasciak , Salah Eddine Boulfelfel , Stefano Leoni

Noncollinear ferroic materials are sought after as testbeds to explore the intimate connections between topology and symmetry, which result in electronic, optical and magnetic functionalities not observed in collinear ferroic materials. For…

The effects of high magnetic fields applied perpendicular to the spontaneous ferroelectric polarization on single crystals of BiFeO$_3$ were investigated through magnetization, magnetostriction, and neutron diffraction measurements. The…

The temperature ($T$) dependence of the optical conductivity spectra $\sigma(\omega)$ of a single crystal SrRuO$_3$ thin film is studied over a $T$ range from 5 to 450 K. We observed significant $T$ dependence of the spectral weights of the…

Ultrafast stimuli can stabilize metastable states of matter inaccessible by equilibrium means. Establishing the spatiotemporal link between ultrafast excitation and metastability is crucial to understanding these phenomena. Here, we use…

Hydrostatic pressure and oxygen vacancies usually have deleterious effects on ferroelectric materials because both tend to reduce their polarization. In this work we use first-principles calculations to study an important class of…

Materials Science · Physics 2021-12-15 Chengliang Xia , Yue Chen , Hanghui Chen

In this paper, an efficient computational material design approach (cluster expansion) is employed for the ferroelectric $PbTiO_3$/$SrTiO_3$ system. Via exploring a conguration space including over $3 \times 10^6$ candidates, two special…

Materials Science · Physics 2015-06-22 Junkai Deng , Alex Zunger , Jefferson Zhe Liu

We present a first-principles investigation of ferroelectricity in layered perovskite oxide La2Ti2O7 (LTO), one of the compounds with highest Curie temperature known (1770 K). Our calculations reveal that LTO's ferroelectric transition…

Materials Science · Physics 2015-05-27 Jorge Lopez-Perez , Jorge Iniguez

Insulating helimagnetic Cu2OSeO3 shows sizeable magnetoelectric effects in its skyrmion phase. Using magnetization measurements, magneto-current analysis and dielectric spectroscopy, we provide a thorough investigation of magnetoelectric…

Strongly Correlated Electrons · Physics 2015-11-05 E. Ruff , P. Lunkenheimer , A. Loidl , H. Berger , S. Krohns

First-principles calculations were performed to investigate the ferroelectric properties of barium titanate and bismuth ferrite, as well as phonon dispersion of BaTiO3, using density functional theory and density functional perturbation…

Materials Science · Physics 2014-12-08 Hong-Jian Feng

Magnetic diffractive scattering of coherent metastable helium atomic beams from CoO(001) surfaces reveal the presence of an anomalous enhancement in the intensity of the half-order antiferromagnetic diffraction peak over the temperature…

Strongly Correlated Electrons · Physics 2007-05-23 P. Banerjee , X. Liu , M. Farzaneh , C. R. Willis , W. Franzen , M. El-Batanouny , V. Staemmler

Measurements of the electrical and thermal conductivities, thermopower and paramagnetic susceptibility have been performed on single crystal samples of Bi1/2Sr1/2MnO3 and complemented with the X-ray powder diffraction data. A pronounced…

Strongly Correlated Electrons · Physics 2009-11-07 J. Hejtmanek , K. Knizek , Z. Jirak , M. Hervieu , C. Martin , M. Nevriva , P. Beran

Low dimensional structures comprised of ferroelectric (FE) PbTiO$_3$ (PTO) and quantum paraelectric SrTiO$_3$ (STO) are hosts to complex polarization textures such as polar waves, flux-closure domains and polar skyrmion phases. Density…

Materials Science · Physics 2022-02-16 Jack S. Baker , David R. Bowler

From extreme strain to bending, the possibilities in the manipulation of freestanding films of oxide perovskites bring a novel landscape to their properties and brings them one step closer to their application. It is therefore of great…

The ferroelectric to paraelectric phase transition in LiTaO$_3$ and in pure as well as Mg doped LiNbO$_3$ is investigated theoretically by atomistic calculations in the framework of the density functional theory, as well as experimentally…