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Using first-principles calculations based on a variational density functional perturbation theory, we investigate the lattice dynamics of solid solutions of barium and strontium titanates. Averaging the information available for the related…

Materials Science · Physics 2009-10-31 Ph. Ghosez , D. Desquesnes , X. Gonze , K. M. Rabe

Above-bandgap femtosecond optical excitation of a ferroelectric/dielectric BaTiO3/CaTiO3 superlattice leads to structural responses that are a consequence of the screening of the strong electrostatic coupling between the component layers.…

Direct manipulation of the atomic lattice using intense long-wavelength laser pulses has become a viable approach to create new states of matter in complex materials. Conventionally, a high frequency vibrational mode is driven resonantly by…

A theory to describe the dielectric anomalies and the ferroelectric phase transition induced by oxygen isotope replacement in SrTiO$_3$ is developed. The proposed model gives consistent explanation between apparently contradictory…

Statistical Mechanics · Physics 2009-11-10 Yasusada Yamada , Norikazu Todoroki , Seiji Miyashita

Solid-state electrolytes (SSEs) require ionic conductivities that are competitive with liquid electrolytes to realize applications in all-solid state batteries. Although numerous materials have been discovered, the underlying mechanisms…

Fluctuations of the atomic positions are at the core of a large class of unusual material properties ranging from quantum para-electricity to high temperature superconductivity. Their measurement in solids is the subject of an intense…

The quantum dynamics of quasiperiodic systems display a rich variety of physical behaviors due to the combination of rotational symmetry that is mathematically forbidden in periodic systems, and long-range order despite the lack of…

Here we have experimentally demonstrated spin-correlation-driven ferroelectric quantum criticality in a prototype quantum spin-liquid system, Ba3CuSb2O9, a quantum phenomenon rarely observed. The dielectric constant follows a clear T2…

Strongly Correlated Electrons · Physics 2026-04-01 Sayan Ghosh , Gourab Roy , Ekta Kushwaha , Mohit Kumar , Tathamay Basu

The driven state of a well-ordered flux line lattice in a single crystal of 2H-NbSe2 in the time domain has revealed the presence of substantial fluctuations in velocity, with large and distinct time periods (~ seconds). A superposition of…

Superconductivity · Physics 2015-05-14 Shyam Mohan , Jaivardhan Sinha , S. S. Banerjee , A. K. Sood , S. Ramakrishnan , A. K. Grover

Pure SrTiO3 in bulk form is known to be an incipient ferroelectric where the quantum fluctuations of lattice positions prevent long range ferroelectric ordering at a finite temperature. We show evidence and identify the origin of…

Strongly Correlated Electrons · Physics 2016-10-19 Vinay Kumar Shukla , Soumik Mukhopadhyay

We have developed first-principles models, based on a general parametrization of the full potential-energy surface, to investigate the lattice-dynamical properties of perovskite oxides. We discuss the application of our method to prototypic…

Materials Science · Physics 2012-04-17 Jacek C. Wojdeł , Patrick Hermet , Mathias P. Ljungberg , Philippe Ghosez , Jorge Íñiguez

We report on growth and ferroelectric (FE) properties of superlattices (SLs) composed of the FE BaTiO3 and the paraelectric (PE) CaTiO3. Previous theories have predicted that the polarization in (BaTiO3)n/(CaTiO3)n SLs increases as the…

Materials Science · Physics 2013-09-09 Sung Seok A. Seo , Ho Nyung Lee

Strontium titanate (SrTiO$_3$), famously described by Nobel laureate K. A. M\"uller as the "drosophila of solid-state physics", has been extensively investigated over the last seventy five years for its intricate coupling of structural,…

Strongly Correlated Electrons · Physics 2026-01-21 Shashank Kumar Ojha , Jyotirmay Maity , Srimanta Middey

The effect of epitaxial strain on the phonon spectra, crystal structure, spontaneous polarization, dielectric, piezoelectric, and elastic properties of (001)-oriented ferroelectric (BaTiO$_3$)$_m$/(SrTiO$_3$)$_n$ superlattices ($m = n =…

Materials Science · Physics 2016-07-11 Alexander I. Lebedev

Femtosecond time-resolved x-ray diffraction is employed to study the dynamics of the periodic lattice distortion (PLD) associated with the charge-density-wave (CDW) in K0.3MoO3. Using a multi-pulse scheme we show the ability to extend the…

Excursions far from their equilibrium structures can bring crystalline solids through collective transformations including transitions into new phases that may be transient or long-lived. Direct spectroscopic observation of…

The intriguing role of nematicity in iron-based superconductors, defined as broken rotational symmetry below a characteristic temperature, is an intensely investigated contemporary subject. Nematicity is closely connected to the structural…

Superconductivity · Physics 2017-05-02 W. Li , Y. Zhang , J. J. Lee , H. Ding , M. Yi , Z. Li , P. Deng , K. Chang , S. -K. Mo , M. Hashimoto , D. H. Lu , X. Chen , R. G. Moore , Q. -K. Xue , Z. -X. Shen

Perovskite BaSnO3 has an Sn s-orbital conduction band minimum, which makes it of interest as a transparent-conducting oxide parent compound but also contraindicates the ferroelectric instability characteristic of the related compound…

Materials Science · Physics 2025-01-07 Jing Li , Qing Zhang , Karin M. Rabe , Xiaohui Liu

The lattice dynamics of coesite has been studied by a combination of diffuse x-ray scattering, inelastic x-ray scattering and an ab initio lattice dynamics calculation. The combined technique gives access to the full lattice dynamics in…

The emerging material class of complex-oxides, where manipulation of physical properties lead to new functionalities at their heterointerfaces, is expected to open new frontiers in Spintronics. For example, SrRuO_3 is a promising material…

Strongly Correlated Electrons · Physics 2015-11-09 S. Roy , C. Autieri , B. Sanyal , T. Banerjee