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Phys. Rev. B 77, 224303 (2008) [7 pages]

Lattice dynamics of beryllium oxide: Inelastic x-ray scattering and ab initio calculations

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Alexey Bosak1, Karin Schmalzl2, Michael Krisch1, Wouter van Beek3,4, and Vitaly Kolobanov5
1European Synchrotron Radiation Facility, Boîte Postale 220, 38043 Grenoble Cedex, France
2Institut für Festkörperforschung, Forschungszentrum Jülich GmbH, Jülich Centre for Neutron Science at ILL, 38042 Grenoble Cedex 9, France
3Swiss-Norwegian Beamlines, ESRF, Boîte Postale 220, 38043 Grenoble Cedex, France
4Dipartamento di Scienze e Tecnologie Avanzate, Universita del Piemonte Orientale and NanoSistemi IC, Via Bellini 25/G, I-15100 Alessandria, Italy
5Faculty of Physics, Moscow State University, 119992 Moscow, Russia

Received 15 April 2008; published 12 June 2008

The phonon-dispersion relations of the lightest wurtzite structure compound BeO have been determined from inelastic x-ray scattering (IXS) measurements and analyzed by ab initio calculations. Experimental data and calculations show good agreement and reconcile the existing controversies. The phonon linewidth of the longitudinal-optical phonon along Γ-A reveals a marked q dependence, which can be correlated with the two-phonon density of states, thus pointing toward a strong anharmonic behavior.

© 2008 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevB.77.224303
DOI:
10.1103/PhysRevB.77.224303
PACS:
63.20.D−, 61.05.cf, 71.15.Mb, 62.20.D−