Related papers: Interplay between local structure and electronic p…
We report a combined x-ray absorption (XAS) and oxygen $K$-edge resonant inelastic x-ray scattering (RIXS) study of charge order in underdoped La$_{2-x}$Sr$_x$CuO$_4$ ($x=0.125$) under uniaxial $c$-axis pressure. We find that compressive…
We report an anomalous local structural response in the CuO2 planes associated with the appearance of charge inhomogeneities at low temperature in underdoped but superconducting La2-x(Sr,Ba)xCuO4. We used pair distribution function analysis…
The temperature dependence of the optical and magnetic properties of CuO were examined by means of hybrid density functional theory calculations. Our work shows that the spin exchange interactions in CuO are neither fully one-dimensional…
The crystal structure of Ca_{2-x}Sr_xRuO_4 with 0.2 < x < 1.0 has been studied by diffraction techniques and by high resolution capacitance dilatometry as a function of temperature and magnetic field. Upon cooling in zero magnetic field…
The local structure of high pressure BaTiO$_3$ has been interrogated by neutron total scattering methods, up to pressures of 4.18 GPa at ambient temperature. Competitive refinements of cubic, tetragonal and rhombohedral distortion modes…
Room temperature Co K-edge extended x-ray absorption fine structure (EXAFS), x-ray absorption near edge structure (XANES) including pre-edge and x-ray diffraction (XRD) studies are carried out on LaCoO3 and PrCoO3. The Co-O, Co-La/Pr and…
The cubic-to-orthorhombic structural transition occurring in CsH at a pressure of about 17 GPa is studied by ab initio calculations. The relative stability of the competing structures and the transition pressure are correctly predicted. We…
We present a density functional study of the structural and electronic properties of small Cu_n (n=1,4) aggregates on defect-free MgO(100). The calculations employ a slab geometry with periodic boundary conditions, supercells with up to 76…
EXAFS spectroscopy experiments have been carried out on quartz-like GaAsO4 and AlAsO4 at high pressure and room temperature. It has been shown that these materials exhibit two structural phase transitions; the first transition to a high…
We present local structural evidence supporting the presence of charge inhomogeneities in the CuO2 planes of underdoped La2-xSrxCuO4. High-resolution atomic pair distribution functions have been obtained from neutron powder diffraction data…
The effects of K and Co substitutions and quasi-hydrostatic applied pressure (P<9 GPa) in the local atomic structure of BaFe2As2, Ba(Fe{0.937}Co{0.063})2As2 and Ba{0.85}K{0.15}Fe2As2 superconductors were investigated by extended x-ray…
Compelling efforts to improve the critical temperature ($T_{c}$) of superconductors have been made through high-pressure application. Understanding the underlying mechanism behind such improvements is critically important, however, much…
Orientation, structure and morphology in the early growth stages of CuO films on strontium titanate were studied by synchrotron radiation X-ray diffraction. Nanostructured CuO films were obtained by ex situ heat treatment at 970 K in oxygen…
The phonon-mediated attractive interaction between carriers leads to the Cooper pair formation in conventional superconductors. Despite decades of research, the glue holding Cooper pairs in high-temperature superconducting cuprates is still…
While the conducting CuO$_2$ planes in cuprate superconductors have been widely recognized as a crucial component in producing high superconducting $T_\text{c}$, recent experimental and theoretical studies on…
The phonon dispersions of $\mathrm{Nd_{1.86}Ce_{0.14}CuO_{4+\delta}}$ along the $[\xi,0,0]$ direction have been determined by inelastic x-ray scattering. Compared to the undoped parent compound, the two highest longitudinal phonon branches,…
The electronic structure of the $(2\sqrt{2}\times\sqrt{2})R45^{\circ}$ O/Cu(001) system has been calculated using locally self-consistent, real space multiple scattering technique based on first principles. Oxygen atoms are found to perturb…
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…
Resonant optical excitation of apical oxygen vibrational modes in the normal state of underdoped YBa2Cu3O6+x induces a transient state with optical properties similar to those of the equilibrium superconducting state. Amongst these, a…
We have performed a systematic first-principles investigation to calculate the structural, electronic, and magnetic properties of PbCrO$_{3}$, CrPbO$_{3}$ as well as their equiproportional combination. The local density approximation…