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Standing on successful first principles predictions for new functional ferroelectric materials, a number of new ferroelectrics have been experimentally discovered. Utilizing trilinear coupling of two types of octahedron rotations, hybrid…

Materials Science · Physics 2015-01-27 Yoon Seok Oh , Xuan Luo , Fei-Ting Huang , Yazhong Wang , Sang-Wook Cheong

Ferroelectric materials are spontaneous symmetry breaking systems characterized by ordered electric polarizations. Similar to its ferromagnetic counterpart, a ferroelectric domain wall can be regarded as a soft interface separating two…

Materials Science · Physics 2021-08-06 Gongzheng Chen , Jin Lan , Tai Min , Jiang Xiao

The exploitation of the spin in charge-based systems is opening revolutionary opportunities for device architecture. Surprisingly, room temperature electrical transport through magnetic nanowires is still an unresolved issue. Here, we show…

Materials Science · Physics 2009-11-10 Varlei Rodrigues , Jefferson Bettini , Paulo C. Silva , Daniel Ugarte

Modeling ferroelectric materials from first principles is one of the successes of density-functional theory, and the driver of much development effort, requiring an accurate description of the electronic processes and the thermodynamic…

Materials Science · Physics 2022-10-26 Lorenzo Gigli , Max Veit , Michele Kotiuga , Giovanni Pizzi , Nicola Marzari , Michele Ceriotti

Ferroelectricity, a spontaneous and reversible electric polarization, is found in certain classes of van der Waals (vdW) material heterostructures. The discovery of ferroelectricity in twisted vdW layers provides new opportunities to…

The so-called interlayer-sliding ferroelectricity was recently proposed as an unconventional route to pursuit electric polarity in van der Waals multi-layers, which was already experimentally confirmed in WTe$_2$ bilayer even though it is…

Materials Science · Physics 2021-08-17 Ning Ding , Jun Chen , Churen Gui , Haipeng You , Xiaoyan Yao , Shuai Dong

The multiferroics are the materials, where single cell of a magnetically order crystal forms an electric dipole moment. We derive equation for the evolution of the macroscopic density of the electric dipole moment (polarization of the…

Materials Science · Physics 2024-07-30 Pavel A. Andreev , Mariya Iv. Trukhanova

We present a theoretical investigation of the anomalous ferroelectricity of mixed-stack charge transfer molecular crystals, based on the Peierls-Hubbard model, and first principles calculations for its parameterization. This approach is…

Materials Science · Physics 2014-09-30 Gabriele D'Avino , Matthieu J. Verstraete

The dynamic control of novel states of matter beyond thermodynamic equilibrium is a fundamental pursuit in condensed matter physics. Intense terahertz fields have enabled metal-insulator transitions, superconductivity, quantum paraelectric…

Ferroelectrics with spontaneous electric polarization play an essential role in today's device engineering, such as capacitors and memories. Their physical properties are further enriched by suppressing the long-range polar order, as is…

Materials Science · Physics 2017-03-14 H. Sakai , K. Ikeura , M. S. Bahramy , N. Ogawa , D. Hashizume , J. Fujioka , Y. Tokura , S. Ishiwata

The goal of this work is studying the evolution of thermoelectric transport across the members of the Ruddlesden-Popper series iridates Srn+1IrnO3n+1, where a metal-insulator transition driven by bandwidth change occurs, from the strongly…

Strongly Correlated Electrons · Physics 2016-01-22 I. Pallecchi , M. T. Buscaglia , V. Buscaglia , E. Gilioli , G. Lamura , F. Telesio , M. R. Cimberle , D. Marre'

Symmetry plays an important role in determining the physical properties in condensed matter physics, as the symmetry operations of any physical property must include the symmetry operations of the point group of the crystal. As a…

Superconductivity · Physics 2024-10-29 Shangfei Wu , Fei-Ting Huang , Xianghan Xu , Ethan T. Ritz , Turan Birol , Sang-Wook Cheong , Girsh Blumberg

High temperature superconducting materials have been known since the pioneering work of Bednorz and Mueller in 1986. While the microscopic mechanism responsible for high Tc superconductivity is still debated, most materials showing high Tc…

Superconductivity · Physics 2021-05-12 Yizhak Yacoby , Davide Ceresoli , Livia Giordano , Yang Shao-Horn

The coexistence of metallicity and ferroelectricity in ferroelectric (FE) metals defies conventional wisdom and enables novel functionalities in electronic and optoelectronic systems. However, intrinsic FE metals remain extremely rare and…

Materials Science · Physics 2025-07-11 Guangrong Tan , Jinyu Zou , Gang Xu

Van der Waals (vdW) heterostructures have opened new opportunities to develop atomically thin (opto)electronic devices with a wide range of functionalities. The recent focus on manipulating the interlayer twist angle has led to the…

In this work we study the transport properties of a finite Peierls-Fr\"ohlich dielectric with a charge density wave of the commensurate type. We show that at low temperatures this problem can be mapped onto a problem of fractional charge…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 I. V. Krive , A. S. Rozhavsky , E. R. Mucciolo , L. E. Oxman

Understanding ionic transport under strong confinement is crucial for the design of next-generation energy, catalytic, and information-processing materials; however, repeated field-driven ion motion often degrades conventional solid…

Materials Science · Physics 2026-01-22 Ata Utku Özkan , Talip Serkan Kasırga , Aykut Erbaş

Ferroelectrics remain in the focus of scientific attention for decades owing to their fundamental and practical appeal. Recently, ferroelectricity has been demonstrated in semiconducting halide perovskites, offering both a rare combination…

Materials Science · Physics 2025-06-17 Ravi Kashikar , S. Lisenkov , I. Ponomareva

The anisotropic propagation of particles is a fundamental transport phenomenon in solid state physics. As for crystalline semiconductors, the anisotropic charge transport opens novel designing routes for electronic devices, where the…

Materials Science · Physics 2025-12-15 Hong Jian Zhao , Yanchao Wang , Laurent Bellaiche , Yanming Ma

With the recent experimental verification that ferroelectric lattice distortions survive in the metallic phase of some materials, there is a desire to create devices that are both switchable and take advantage of the novel functionalities…

Mesoscale and Nanoscale Physics · Physics 2022-02-10 Kelsey S. Chapman , W. A. Atkinson