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Cathode materials undergo various phase transitions during the charge/discharge process, and the structural transitions significantly affect the battery performance. Although phonon properties can provide a direct clue for structural…

Materials Science · Physics 2022-08-08 Haeyoon Jung , Jiyeon Kim , Sooran Kim

A theoretical study has been carried out to analyse the available results from the inelastic neutron scattering experiment performed on a quasi-two dimensional spin-1/2 ferromagnetic material $K_2CuF_4$. Our formalism is based on a…

Strongly Correlated Electrons · Physics 2014-10-23 Subhajit Sarkar , Samir K. Paul , Ranjan Chaudhury

The phonon spectrum of cubic cadmium metastannate and the crystal structures of its distorted phases were calculated from first principles within the density functional theory. It is shown that the phonon spectrum and the energy spectrum of…

Materials Science · Physics 2016-01-08 A. I. Lebedev

The Ising triangular lattice remains the classic test-case for frustrated magnetism. Here we report neutron scattering measurements of short range magnetic order in CuMnO$_2$, which consists of a distorted lattice of Mn$^{3+}$ spins with…

Strongly Correlated Electrons · Physics 2020-08-13 Simon A. J. Kimber , Andrew Wildes , Hannu Mutka , Jan-Willem G. Bos , Dimitri N. Argyriou

In order to explore the driving mechanism of the concomitant metal-insulator and structural transitions in quasi-one-dimensional hollandite K$_{2}$Cr$_{8}$O$_{16}$, electronic structures and phonon properties are investigated by employing…

Strongly Correlated Electrons · Physics 2014-12-05 Sooran Kim , Kyoo Kim , B. I. Min

The recent discovery of quasi-one-dimensional Chromium-based superconductivity has generated much excitement. We study in this work the superconducting instabilities of a representative compound, the newly synthesized KCr$_3$As$_3$…

Superconductivity · Physics 2019-03-27 Li-Da Zhang , Xiaoming Zhang , Juan-Juan Hao , Wen Huang , Fan Yang

SrTiO$_3$ has been extensively investigated owing to its abundant degrees of freedom for modulation. However, the microscopic mechanism of thermal transport especially the relationship between phonon scattering and lattice distortion during…

Materials Science · Physics 2023-03-15 Jian Han , Changpeng Lin , Ce-wen Nan , Yuan-hua Lin , Ben Xu

The available results from the inelastic neutron scattering experiment performed on the quasi-two dimensional spin $\frac{1}{2}$ anti-ferromagnetic material $La_2 Cu O_4$ have been analysed theoretically. The formalism of ours is based on a…

Strongly Correlated Electrons · Physics 2016-09-26 Subhajit Sarkar , Ranjan Chaudhury , Samir K. Paul

Here we report on an elastic and inelastic neutron scattering study addressing the effect of electric fields on quantum paraelectric SrTiO3. Our elastic scattering results find small changes as a function of field in a superlattice…

It has been proposed that Sr_2RuO_4 exhibits spin triplet superconductivity mediated by ferromagnetic fluctuations. So far neutron scattering experiments have failed to detect any clear evidence of ferromagnetic spin fluctuations but,…

Strongly Correlated Electrons · Physics 2009-11-10 T. Nagata , M. Urata , H. Kawano-Furukawa , H. Yoshizawa , H. Kadowaki , P. Dai

Neutrons have played an important role in advancing our understanding of the pairing mechanism and the symmetry of the superconducting energy gap in the iron arsenide compounds. Neutron measurements of the phonon density-of-state are in…

Superconductivity · Physics 2014-07-15 R. Osborn , S. Rosenkranz , E. A. Goremychkin , A. D. Christianson

Inelastic neutron scattering measurements are reported that show a new longitudinal mode in the antiferromagnetically ordered phase of the spin-1/2 quasi-one-dimensional antiferromagnet KCuF3. This mode signals the cross-over from…

Strongly Correlated Electrons · Physics 2009-10-31 B. Lake , D. A. Tennant , S. E. Nagler

In this paper, we study the structurally nonlinear stability of supersonic contact discontinuities in three-dimensional compressible isentropic steady flows. Based on the weakly linear stability result and the $L^2$-estimates obtained by…

Analysis of PDEs · Mathematics 2014-07-08 Ya-Guang Wang , Fang Yu

Rattling dynamics have been identified as fundamental to superconductivity in defect pyrochlore osmates and aluminium vanadium intermetallics, as well as low thermal conductivity in clathrates and filled skutterudites. Combining inelastic…

The low-energy part of the vibration spectrum in KNbO$_3$ was studied by cold neutron inelastic scattering in the cubic phase. In addition to acoustic phonons, we observe strong diffuse scattering, which consists of two components. The…

Materials Science · Physics 2007-05-23 S. N. Gvasaliya , B. Roessli , R. A. Cowley , S. G. Lushnikov , A. Choubey , P. Gunter

I show the infinite-layer rare-earth nickelates are near a structural quantum critical point by mapping the energetics of their structural instabilities using first priniciples calculations. I first confirm previous results that show a…

Materials Science · Physics 2023-08-17 Alaska Subedi

Distortions of the $\sqrt3\times\sqrt3$ Sn/Ge(111) and Sn/Si(111) surfaces are shown to reflect a disproportionation of an integer pseudocharge, $Q$, related to the surface band occupancy. A novel understanding of the $(3\times3)$-1U (``1…

Materials Science · Physics 2009-11-07 G. Ballabio , G. Profeta , S. de Gironcoli , S. Scandolo , G. E. Santoro , E. Tosatti

For Y$_2$C$_3$ with a superconducting critical temperature (T$_c$) $\sim$18 K, zone-center imaginary optical phonon modes have been found for the high-symmetry $I$-$43d$ structure due to C dimer wobbling motion and electronic instability…

Superconductivity · Physics 2024-02-23 Niraj K. Nepal , Paul C. Canfield , Lin-Lin Wang

We present the results of a neutron scattering study of the high energy phonons in the superconducting graphite intercalation compound CaC$_6$. The study was designed to address hitherto unexplored aspects of the lattice dynamics in…

Slow dynamics of energy transfer between different phonon modes under the resonance conditions is considered. It may result in new effects in the inelastic and quasielastic neutron scattering spectra.

Materials Science · Physics 2009-11-10 M. I. Katsnelson , A. V. Trefilov