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Título
Nonadiabatic Kohn Anomaly in Heavily Boron-Doped Diamond
Autor
Año del Documento
2017
Editorial
American Physical Society
Documento Fuente
Phys. Rev. Lett. 119, 017001 (2017)
Résumé
We report evidence of a nonadiabatic Kohn anomaly in boron-doped diamond, using a joint theoretical and experimental analysis of the phonon dispersion relations. We demonstrate that standard calculations of phonons using density-functional perturbation theory are unable to reproduce the dispersion relations of the high-energy phonons measured by high-resolution inelastic x-ray scattering. On the contrary, by taking into account nonadiabatic effects within a many-body field-theoretic framework, we obtain excellent agreement with our experimental data. This result indicates a breakdown of the Born-Oppenheimer approximation in the phonon dispersion relations of boron-doped diamond.
Revisión por pares
SI
Patrocinador
European Union Horizon 2020
Leverhulme Trust
United Kingdom Engineering and Physical Sciences Research Council
University of Oxford Advanced Research Computing facility
ARCHER United Kingdom National Supercomputing Service
European Synchrotron Radiation Facility - ESRF
Leverhulme Trust
United Kingdom Engineering and Physical Sciences Research Council
University of Oxford Advanced Research Computing facility
ARCHER United Kingdom National Supercomputing Service
European Synchrotron Radiation Facility - ESRF
Idioma
eng
Tipo de versión
info:eu-repo/semantics/publishedVersion
Derechos
openAccess
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