Self-consistent phonons in fcc
- 1 August 1978
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 18 (3), 1132-1143
- https://doi.org/10.1103/physrevb.18.1132
Abstract
The dynamic form factor, , of fcc at high density is calculated, including the one-phonon, the two-phonon, and interference contributions, for comparison with the recent neutron-scattering measurements of Eckert et al. and of Thomlinson et al. The purpose is to test how well the standard self-consistent phonon (SCP) theory, which takes no account of short-range correlations in the atomic vibration, can describe a moderately anharmonic crystal such as fcc . The SCP theory is found to provide a good overall description of the neutron scattering data including both the one-phonon and multiphonon character. It is also found that the usual separation of , into a one-phonon and multiphonon contribution becomes difficult or impossible for wave-vector transfers with at high-energy transfer. This is due to an unusually large frequency dependence of the two-phonon scattering contribution to .
Keywords
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