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The pressure-dependent relation between Eu valence and lattice structure in model compound EuO is studied with synchrotron-based x-ray spectroscopic and diffraction techniques. Contrary to expectation, a 7% volume collapse at $\approx$ 45…

Strongly Correlated Electrons · Physics 2015-06-04 N. M. Souza-Neto , J. Zhao , E. E. Alp , G. Shen , S. V. Sinogeikin , G. Lapertot , D. Haskel

The local electronic and magnetic properties of superconducting FeSe have been investigated by K$\beta$ x-ray emission (XES) and simultaneous x-ray absorption spectroscopy (XAS) at the Fe K-edge at high pressure and low temperature. Our…

Superconductivity · Physics 2018-05-09 B. W. Lebert , V. Balédent , P. Toulemonde , J. M. Ablett , J. -P. Rueff

The high-pressure behavior of monoclinic VO$_2$ is revisited by a combination of Raman spectroscopy and X-ray diffraction on a single crystal under hydrostatic conditions at room temperature. A soft mode is observed up to P$_c$ = 13.9(1)…

Strongly Correlated Electrons · Physics 2025-01-14 P. Bouvier , L. Bussmann , D. Machon , I. Breslavetz , G. Garbarino , P. Strobel , V. Dmitriev

We present a detailed theoretical study of the electronic, magnetic, and structural properties of magnesiow\"ustite Fe$_{1-x}$Mg$_x$O with $x$ in the range between 0$-$0.875 using a fully charge self-consistent implementation of the density…

Strongly Correlated Electrons · Physics 2017-08-24 I. Leonov , A. Ponomareva , R. Nazarov , I. A. Abrikosov

Motivated by pressure experiments on FeAs-122 superconductors, we propose a scenario based on local-moment physics to explain the simultaneous disappearance of magnetism, reduction of the unit cell volume, and decrease in resistivity. In…

Superconductivity · Physics 2015-05-13 Andreas Hackl , Matthias Vojta

We have studied the volume collapse of LaMnO$_3$ at the Jahn- Teller (JT) transition temperature T$_{JT}$=750 K which has recently been found in high temperature powder x- ray and neutron diffraction experiments. We construct a model…

Strongly Correlated Electrons · Physics 2009-11-10 T. Maitra , P. Thalmeier , T. Chatterji

We report on the synthesis of superconducting single crystals of FeSe, and their characterization by X-ray diffraction, magnetization and resistivity. We have performed ac susceptibility measurements under high pressure in a hydrostatic…

Superconductivity · Physics 2015-05-13 D Braithwaite , B Salce , G Lapertot , F Bourdarot , C Marin , D Aoki , M Hanfland

The structural, vibrational, electronic, and magnetic properties of inverse spinel $Co_2TiO_4$ (CTO-Sp) under high-pressure (HP) conditions are systematically investigated using X-ray diffraction, Raman spectroscopy, in situ optical…

We report a detailed investigation of GdO$_{1-x}$F$_{x}$FeAs (x = 0, 0.07 and 0.14) samples by means of high-field/high-frequency electron spin resonance (HF-ESR) together with measurements of thermodynamic and transport properties. The…

(MgFe)O is a solid solution with ferrous iron undergoing the high to low spin state (HS-LS) crossover under high pressure. The exact state of the material in the region of the crossover is still a mystery, as domains with different spin…

Materials Science · Physics 2020-05-20 Konstantin Glazyrin , Saiana Khandarkhaeva , Leonid Dubrovinsky , Michael Sprung

The accuracy of LDA + U total energies is tested by predicting the high pressure behavior of rocksalt-structured FeO, including metal-insulator and magnetic transitions, equation of state, and lattice strain, as functions of the Coulomb…

Strongly Correlated Electrons · Physics 2007-05-23 S. A. Gramsch , R. E. Cohen , S. Y. Savrasov

The recent surge of interest in phase change materials GeTe, Ge$_2$Sb$_2$Te$_5$, and related compounds motivated us to revisit the structural phase transition in GeTe in more details than was done before. Rhombohedral-to-cubic ferroelectric…

Materials Science · Physics 2015-03-19 Tapan Chatterji , C. M. N. Kumar , Urszula D. Wdowik

It is argued that the formation of the non-magnetic state of FeS in external pressures above 6.5 GPa is in agreement with the prediction of the quantum atomistic solid-state theory, an extension of the crystal-field theory with the…

Strongly Correlated Electrons · Physics 2007-05-23 Z. Ropka , R. J. Radwanski

The structural properties of LaCoO3 were studied by means of high-resolution neutron powder diffraction in the temperature range 5<T<1000 K. Changes of the Co+3 spin states in this temperature interval are shown to affect not only the unit…

Strongly Correlated Electrons · Physics 2009-11-07 Paolo G. Radaelli , Sang-Wook Cheong

We investigate the crystal structure and lattice vibrations of Sr$_2$IrO$_4$ by a combined phonon Raman scattering and x-ray powder diffraction experiment under pressures up to $66$ GPa and room temperature. Density functional theory (DFT)…

Strongly Correlated Electrons · Physics 2018-09-05 K. Samanta , F. M. Ardito , N. M. Souza-Neto , E. Granado

In-situ high pressure single crystal X-ray diffraction study reveals that the quantum material CaMn$_2$Bi$_2$ undergoes a unique plane to chain structural transition between 2 and 3 GPa, accompanied by a large volume collapse. CaMn2Bi2…

Materials Science · Physics 2019-07-18 Xin Gui , Gregory J. Finkelstein , Keyu Chen , Tommy Yong , Przemyslaw Dera , Jinguang Cheng , Weiwei Xie

The results of magnetic and spectral properties calculation for paramagnetic phase of ferropericlase (Fe$_{1/4}$Mg$_{3/4}$)O at ambient and high pressures are reported. Calculations were performed by combined Local Density Approximation +…

Materials Science · Physics 2014-11-21 N. A. Skorikov , A. O. Shorikov , S. L. Skornyakov , M. A. Korotin

In a joint experimental and theoretical study, we investigate the isostructural collapse from the ambient pressure tetragonal phase to a collapsed tetragonal phase for non-superconducting metallic SrFe2As2 and SrFe_1.8Ru_0.2As_2. The…

We report the evolution of the electronic nematic susceptibility in FeSe via Raman scattering as a function of hydrostatic pressure up to 5.8 GPa where the superconducting transition temperature $T_{c}$ reaches its maximum. The critical…