Three-Body Forces in the Lattice Dynamics of Beryllium

C. M. Bertoni, V. Bortolani, C. Calandra, and F. Nizzoli
Phys. Rev. Lett. 31, 1466 – Published 10 December 1973
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Abstract

We present a first-principles calculation of the lattice dynamics of Be. The dynamical matrix is set up by evaluating the total electron energy up to third order in the electron-ion pseudopotential. In this way we are able to describe the three-body forces, which are essential for reproducing the experimental data.

  • Received 28 September 1973

DOI:https://doi.org/10.1103/PhysRevLett.31.1466

©1973 American Physical Society

Authors & Affiliations

C. M. Bertoni, V. Bortolani, C. Calandra, and F. Nizzoli

  • Istituto di Fisica and Gruppo Nazionale Struttura della Materia, Università di Modena, Modena, Italy

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Issue

Vol. 31, Iss. 24 — 10 December 1973

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