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000857971 1001_ $$0P:(DE-HGF)0$$aLiu, B.-Q.$$b0$$eCorresponding author
000857971 245__ $$aLattice dynamics and coupled quadrupole-phonon excitations in CeAuAl 3
000857971 260__ $$aWoodbury, NY$$bInst.$$c2018
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000857971 520__ $$aWe report first principles calculations of the structural parameters and phonon dispersion of the tetragonalnoncentrosymmetric heavy fermion compound CeAuAl3. Taking into account weak magnetoelastic interactionsof the rare-earth (RE) ions with the spectrum of phonons, we obtain an analytical expression for the hybridizationof quadrupole excitations and phonons from the poles of the one-phonon Green function. In the paramagneticphase, we predict the formation of mixed modes that may be observed by inelastic neutron scattering. Our resultsshow that magnetoelastic interactions, albeit being moderate, play an important role in CeAuAl3. This suggeststhat magnetoelastic interactions may be equally important in a wide range of related compounds.
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