Interatomic forces, phonons, the Foreman-Lomer theorem and the Blackman sum rule

Andrew M. Stewart*

*Corresponding author for this work

    Research output: Contribution to journalArticlepeer-review

    1 Citation (Scopus)

    Abstract

    Foreman and Lomer proposed in 1957 a method of estimating the harmonic forces between parallel planes of atoms of primitive 0cubic crystals by Fourier transforming the squared frequencies of phonons propagating along principal directions. A generalized form of this theorem is derived in this paper and it is shown that it is more appropriate to apply the method to certain combinations of the phonon dispersion relations rather than to individual dispersion relations themselves. Further, it is also shown how the method may be extended to the hexagonal close packed and diamond lattices. Explicit, exact and general relations in terms of atomic force constants are found for deviations from the Blackman sum rule which itself is shown to be derived from the generalized Foreman-Lomer theorem.

    Original languageEnglish
    Pages (from-to)3439-3452
    Number of pages14
    JournalInternational Journal of Modern Physics B
    Volume15
    Issue number26
    DOIs
    Publication statusPublished - 20 Oct 2001

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