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Related papers: First principles lattice dynamics of NaCoO$_2$

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Density Functional Theory (DFT) calculations not only allow to predict the vibrational and optical properties of solids but also to understand and disentangle the mechanisms playing a key role in the generation of coherent optical phonons.…

Materials Science · Physics 2025-10-09 A. Levchuk , R. Busselez , G. Vaudel , P. Ruello , V. Juvé , B. Arnaud

We have performed extensive ab initio calculations to investigate phonon dynamics and their possible role in superconductivity in BaFe2As2 and related systems. The calculations are compared to inelastic neutron scattering data that offer…

Superconductivity · Physics 2009-11-13 M. Zbiri , H. Schober , M. R. Johnson , S. Rols , R. Mittal , Y. Su , M. Rotter , D. Johrendt

UV Raman scattering studies show longitudinal optical (LO) mode up to 4th order in wurtzite GaN nanowire system. Frohlich interaction of electron with the long range electrostatic field of ionic bonded GaN gives rise to enhancement in LO…

Phonon modes and their association with the electronic states have been investigated for the metallic EuCu$_{2}$As$_{2}$ system. In this work, we present the Raman spectra of this pnictide system which clearly shows the presence of seven…

Strongly Correlated Electrons · Physics 2025-01-10 Debasmita Swain , Mainak Dey Sarkar , Andrzej Ptok , G. Vaitheeswaran , Anushree Roy , Sitikantha D Das

As momentum-resolved Electron Energy Loss Spectroscopy (q-EELS) becomes more widely used for phonon measurements, better understanding of the intricacies of the acquired signal is necessary. Selection rules limit the allowed scattering,…

An algorithm for mapping the true phonon modes of a film, which are defined by a two-dimensional (2D) Brillouin zone, to the modes of the corresponding bulk material, which are defined by a three-dimensional (3D) Brillouin zone, is…

Mesoscale and Nanoscale Physics · Physics 2020-01-08 Hyun-Young Kim , Kevin D. Parish , Alan J. H. McGaughey

The ferropnictide superconductors exhibit a sensitive interplay between the lattice and magnetic degrees of freedom, including a number of phonon modes that are much softer than predicted by nonmagnetic calculations using density functional…

Superconductivity · Physics 2014-03-13 D. Parshall , R. Heid , J. L. Niedziela , Th. Wolf , M. B. Stone , D. L. Abernathy , D. Reznik

Digital video-microscopy measurements are reported of both elastic bandstructures and overdamped phonon decay times in two-dimensional colloidal crystals. Both quantities together allow to determine the friction coefficients along various…

Other Condensed Matter · Physics 2008-05-13 Joerg Baumgartl , Julian Dietrich , Jure Dobnikar , Clemens Bechinger , Hans Hennig von Gruenberg

We report on the structural and spectroscopic characterization of the multiferroic Fe$_2$Mo$_3$O$_8$. Synchrotron x-ray and neutron diffraction, as well as thermal expansion measurements reveal a lattice anomaly at $T_{\mathrm{N}}\simeq…

Strongly Correlated Electrons · Physics 2020-09-28 S. Reschke , A. A. Tsirlin , N. Khan , L. Prodan , V. Tsurkan , I. Kézsmárki , J. Deisenhofer

We explore the Fano resonance in ZrTe5, using Raman scattering measurements. We identified two closely spaced B2g phonon modes, B2g I and B2g II, around 9 meV and 10 meV, respectively. Interestingly, only B2g I exhibited the Fano resonance,…

The Raman spectra of the parent compound NaxCoO2 (x=0.75) and the superconducting oxyhydrates NaxCoO2.yH2O with different superconducting temperatures (Tc) have been measured. Five Raman active phonons around 195 cm-1 (E1g), 482 cm-1, 522…

Superconductivity · Physics 2009-11-10 Y. G. Shi , Y. L. Liu , H. X. Yang , C. J. Nie , R. Jin , J. Q. Li

We report on polarized infrared reflectivity measurements of multiferroic, monoclinic MnWO4 between 10K and 295K. The full dielectric tensor and the frequency dependence of the orientation of the principal axes have been determined in the…

Strongly Correlated Electrons · Physics 2014-10-08 T. Möller , P. Becker , L. Bohaty , J. Hemberger , M. Grüninger

The infrared conductivity of NaxCoO2 is studied as a function of doping and temperature for x between 0.5 and 1. Charge localization in CoO2 layers shows up through a far-infrared peak (FIP) in the infrared conductivity which coexists with…

Strongly Correlated Electrons · Physics 2009-11-11 S. Lupi , M. Ortolani , L. Baldassarre , P. Calvani , D. Prabhakaran , A. T. Boothroyd

Raman scattering experiments have been performed on Na_xCoO_2 as function of temperature at the composition x=0.5 where a structural instability and a metal-insulator transition have been observed. Three additional phonon modes are observed…

Strongly Correlated Electrons · Physics 2010-03-09 X. N. Zhang , P. Lemmens , V. Gnezdilov , K. Y. Choi , B. Keimer , D. P. Chen , C. T. Lin , F. C. Chou

Impulsive optical excitation can generate both coherent and squeezed phonons. The expectation value of the phonon displacement $<u_q>$ oscillates at the mode frequency for the coherent state but remains zero for a pure squeezed state. In…

Materials Science · Physics 2016-07-27 T. Henighan , M. Trigo , M. Chollet , J. N. Clark , S. Fahy , J. M. Glownia , M. P. Jiang , M. Kozina , H. Liu , S. Song , D. Zhu , D. A. Reis

The ability to use photonic quasiparticles to control electromagnetic energy far below the diffraction limit is a defining paradigm in nanophotonics. An important recent development in this field is the measurement and manipulation of…

We present, in this work, our theoretical results for the phonon dispersions and the frequency dependence of the reflectivities and the dielectric constants of ZrO2 and HfO2 in the monoclinic phase. The results show the importance of the…

Materials Science · Physics 2009-11-11 C. C. Silva , H. W. Leite Alves , L. M. R. Scolfaro

We investigate the process of the second harmonic generation by plasmonic nano-antennas that exhibit Fano-like resonances. A rigorous fully vectorial Maxwell-hydrodynamics approach is employed to directly calculate the second order…

Optics · Physics 2022-09-27 Maxim Sukharev , Elena Drobnyh , Ruth Pachter

We calculate the lattice dielectric function of strongly anharmonic rutile $\mathrm{TiO}_2$ from ab initio anharmonic lattice dynamics methods. Since an accurate calculation of the $\Gamma$ point phonons is essential for determining optical…

Materials Science · Physics 2023-03-24 Tomohito Amano , Tamio Yamazaki , Ryosuke Akashi , Terumasa Tadano , Shinji Tsuneyuki

The lattice dynamic properties and spin-phonon coupling in DyMn$_2$O$_5$ are studied by using the density-functional theory. The calculated phonon frequencies are in very good agreement with experiments. We then compare the phonon modes…

Materials Science · Physics 2009-11-13 Tianqi Shen , Kun Cao , Guang-Can Guo , Lixin He
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