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This study introduces a new chemical method for controlling the strain in methylammonium lead iodide (MAPbI3) perovskite crystals by varying the ratio of Pb(Ac)2 and PbCl2 in the precursor solution. To observe the effect on crystal strain,…

Charge disproportionation transitions in complex oxides most commonly link high-temperature phases containing identical cations with the same oxidation state and crystallographic site, to low-temperature phases in which charge transfer…

材料科学 · 物理学 2019-01-09 Ulrich Aschauer , Nathalie Vonrüti , Nicola A. Spaldin

We have investigated the structural phase transitions of the transition metal oxide perovskites SrTiO$_{3}$, LaAlO$_{3}$ and LaTiO$_{3}$ using the screened hybrid density functional of Heyd, Scuseria and Ernzerhof (HSE06). We show that…

Ferroelectric BaTiO3 films with large polarization have been integrated with Si(001) by pulsed laser deposition. High quality c-oriented epitaxial films are obtained in a substrate temperature range of about 300 deg C wide. The deposition…

材料科学 · 物理学 2018-01-25 Jike Lyu , Ignasi Fina , Raul Solanas , Josep Fontcuberta , Florencio Sanchez

Using an extension of a first-principles method developed by King-Smith and Vanderbilt [Phys. Rev. B {\bf 49}, 5828 (1994)], we investigate the effects of in-plane epitaxial strain on the ground-state structure and polarization of eight…

材料科学 · 物理学 2009-12-22 Oswaldo Dieguez , Karin M. Rabe , David Vanderbilt

Using \emph{ab initio} band structure and DFT+dynamical mean-field theory methods we examine the effects of electron-electron interactions on the electronic structure, magnetic state, and structural phase stability of the recently…

强关联电子 · 物理学 2026-01-26 I. V. Leonov

The evolution from superconducting LiTi2O4-delta to insulating Li4Ti5O12 thin films has been studied by precisely adjusting the oxygen pressure during the sample fabrication process. In the superconducting LiTi2O4-delta films, with the…

La$_2$NiO$_4$ is a very promising cathode material for intermediate and low temperature solid oxide cell applications, due to its good electronic and ionic conductivity, together with its high oxygen exchange activity with a low activation…

Transition metal oxides have generated significant interest for their potential as catalysts for the oxygen evolution reaction (OER) in alkaline environments. Iron and nickel-based perovskite oxides have proven particularly promising, with…

The effects of strain on a film of mulitferroic GdMnO3 are investigated using both magnetometry and magneto-optic spectroscopy. Optical spectra, in the energy range 1.5eV - 3.5eV, were taken in Faraday geometry in an applied magnetic field…

This study examines the application of transition metal-doped SrTiO3 in photovoltaic technologies, such as photocatalysis. The core objective is to evaluate how different dopants influence the structural and electronic characteristics of…

Recent studies have shown that the magnetic properties of the ferromagnetic perovskite oxide La$_{2/3}$ Sr$_{1/3}$ MnO$_3$ (LSMO) grown on an SrTiO3 (STO) substrate, such as its magnetic moment and Curie temperature, can be improved by…

We address the fundamental issue of growth of perovskite ultra-thin films under the condition of a strong polar mismatch at the heterointerface exemplified by the growth of a correlated metal LaNiO$_3$ on the band insulator SrTiO$_3$ along…

强关联电子 · 物理学 2014-12-23 S. Middey , P. Rivero , D. Meyers , M. Kareev , X. Liu , Y. Cao , J. W. Freeland , S. Barraza-Lopez , J. Chakhalian

Recent experiments in La$_{1-x}$Ba$_x$MnO$_3$ thin films by Zhang {\it et al.} {[Phys. Rev. B {\bf 64}, 184404 (2001)]} showed that the ferromagnetic Curie temperature $T_c$ is enhanced (reduced) by tensile (compressive) strain. The results…

强关联电子 · 物理学 2007-05-23 Qingshan Yuan

For applying tensile or compressive uniaxial strain to functional thin films, we propose a novel approach in combining a piezoelectric-based device and a technical metallic substrate used widely in the 2nd generation coated conductors (i.e.…

Nitride perovskites are an emerging class of materials that have been predicted to display a range of interesting physics and functional properties, but they are under-explored due to the difficulty of synthesizing oxygen-free nitrides.…

The nature of the metal insulator transition in thin films and superlattices of LaNiO3 with only few unit cells in thickness remains elusive despite tremendous effort. Quantum confinement and epitaxial strain have been evoked as the…

Due to the complex interplay of magnetic, structural, electronic, and orbital degrees of freedom, biaxial strain is known to play an essential role in the doped manganites. For coherently strained La(2/3)Ca(1/3)MnO(3) thin films grown on…

强关联电子 · 物理学 2009-11-07 J. Klein , J. B. Philipp , G. Carbone , A. Vigliante , L. Alff , R. Gross

Electrical transport properties of RNiO3 (R= Pr, Nd, Sm) thin films grown by pulse laser deposition have been studied. RNiO3 films grow in (100) direction on LaAlO3 (100) substrate. Unlike in polycrystalline solid, PrNiO3 film showed…

材料科学 · 物理学 2007-05-23 A. Venimadhav , I. Chaitanyalakshmi , M. S. Hegde

Flexoelectricity - polarization induced by strain gradients - offers a route to polar functionality in centrosymmetric dielectrics, where traditional piezoelectric effects are absent. This study investigates the flexoelectric effect in…

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