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The effect of pressure on the zone-center optical phonon modes of antimony in the A7 structure has been investigated by Raman spectroscopy. The A_g and E_g frequencies exhibit a pronounced softening with increasing pressure, the effect…

Other Condensed Matter · Physics 2009-11-11 X. Wang , K. Kunc , I. Loa , U. Schwarz , K. Syassen

The pressure dependence of a large number of phonon modes in CaFe2As2 with energies covering the full range of the phonon spectrum has been studied using inelastic x-ray and neutron scattering. The observed phonon frequency changes are in…

Density functional perturbation theory calculations of alpha-quartz using extended norm conserving pseudopotentials have been used to study the elastic properties and phonon dispersion relations along various high symmetry directions as a…

Materials Science · Physics 2007-05-23 N. Choudhury , S. L. Chaplot

The effect of pressure on optical phonon frequencies of MgB$_2$ has been calculated using the frozen-phonon approach based on a pseudopotential method. Gr\"uneisen parameters of the harmonic mode frequencies are reported for the…

Superconductivity · Physics 2009-11-07 K. Kunc , I. Loa , K. Syassen , R. K. Kremer , K. Ahn

The effect of pressure and temperature on the Raman-active phonon mode of osmium metal has been investigated for pressures up to 20 GPa and temperatures in the range 10--300 K. Under hydrostatic conditions (He pressure medium) the phonon…

Other Condensed Matter · Physics 2009-11-11 Yu. S. Ponosov , I. Loa , V. E. Mogilenskikh , K. Syassen

Crystalline structures, zone-center phonon modes, and the related dielectric response of the three low-pressure phases of HfO2 have been investigated in density-functional theory using ultrasoft pseudopotentials and a plane-wave basis. The…

Materials Science · Physics 2009-11-07 Xinyuan Zhao , David Vanderbilt

Ammonium sulfate is a giant inverse barocaloric material that is cheaply and commercially available. Exploiting its potential for cooling applications requires an understanding of the mechanism driving the entropy change. Here we report an…

Topological phase transitions occur when the electronic bands change their topological properties, typically featuring the closing of the bandgap. While the influence of topological phase transitions on electronic and optical properties has…

Materials Science · Physics 2021-01-04 Shengying Yue , Bowen Deng , Yanming Liu , Yujie Quan , Runqing Yang , Bolin Liao

We report a Raman study of the effect of temperature on the self-energies of optical phonons in a number of transition metals with hexagonal-close-packed structure. Anisotropic softening of phonon energies and narrowing of phonon linewidths…

Materials Science · Physics 2017-01-04 Yu. S. Ponosov , S. V. Streltsov

Structural stability of paramagnetic (PM) body-centered cubic (bcc) Fe under pressure is investigated based on first-principles phonon calculations. Spin configurations of the PM phase are approximated using a binary special quasi-random…

Materials Science · Physics 2015-06-22 Yuji Ikeda , Atsuto Seko , Atsushi Togo , Isao Tanaka

Raman spectra of the MgB2 ceramic samples were measured as a function of pressure up to 32 GPa at room temperature. The spectrum at normal conditions contains a very broad peak at ~590 cm-1 related to the E2g phonon mode. The frequency of…

Materials Science · Physics 2009-11-07 K. P. Meletov , J. Arvanitidis , M. P. Kulakov , N. N. Kolesnikov , G. A. Kourouklis

Exfoliated black phosphorus has recently emerged as a new two-dimensional crystal that, due to its peculiar and anisotropic crystalline and electronic band structures, may have potentially important applications in electronics,…

The IR- and Raman-active phonon frequencies, as well as the elastic constants of orthorhombic GeSe, were calculatedas a function of hydrostatic pressure using the method of density functional in the ABINIT software package. Comparison with…

Materials Science · Physics 2013-03-12 F. M. Hashimzade , D. A. Huseinova , Z. A. Jahangirli , B. H. Mehdiyev , G. S. Orudzhev

Unlike in ordinary metals, in graphene, phonon structure can be seen in the quasiparticle electronic density of states, because the latter varies on the scale of the phonon energy. In a magnetic field, quantization into Landau levels…

Mesoscale and Nanoscale Physics · Physics 2015-05-28 Adam Pound , J. P. Carbotte , E. J. Nicol

In this work we present the results of an inelastic x-ray scattering experiment detailing the behavior of the transverse acoustic [110] phonon in BaFe2As2 as a function of temperature. When cooling through the structural transition…

Superconductivity · Physics 2012-01-04 Jennifer L. Niedziela , D. Parshall , K. A. Lokshin , A. S. Sefat , A. Alatas , T. Egami

Advances in light sources and time resolved spectroscopy have made it possible to excite specific atomic vibrations in solids and to observe the resulting changes in electronic properties but the mechanism by which phonon excitation causes…

Superconductivity · Physics 2017-05-05 Dante M. Kennes , Eli Y. Wilner , David R. Reichman , Andrew J. Millis

First-principles calculations are used in order to investigate phonon anomalies in non-magnetic and magnetic Heusler alloys. Phonon dispersions for several systems in their cubic L2$\mathrm{_1}$ structure were obtained along the [110]…

Materials Science · Physics 2016-08-31 A. T. Zayak , P. Entel , K. M. Rabe , W. A. Adeagbo , M. Acet

Ferromagnetic \nmg has unique magnetoelastic properties. These are investigated by detailed computational studies of the phonon dispersion curves for the non-modulated cubic \Ltw and tetragonal structures. For the \Ltw\ structure, a…

Materials Science · Physics 2009-11-10 A. T. Zayak , P. Entel , J. Enkovaara , A. Ayuela , R. M. Nieminen

We report an experimental determination of the dispersion of the soft phonon mode along [1,0,0] in uranium as a function of pressure. The energies of these phonons increase rapidly, with conventional behavior found by 20 GPa, as predicted…

Strongly Correlated Electrons · Physics 2015-03-19 S. Raymond , J. Bouchet , G. H. Lander , M. Le Tacon , G. Garbarino , M. Hoesch , J. -P. Rueff , M. Krisch , J. C. Lashley , R. K. Schulze , R. C. Albers

Experiments studying phonon mediated drag in the double layer two dimensional electron gas system are reported. Detailed measurements of the dependence of drag on temperature, layer spacing, density ratio, and matched density are discussed.…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 H. Noh , S. Zelakiewicz , T. J. Gramila , L. N. Pfeiffer , K. W. West
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