Abstract
Recent high pressure x-ray experiments show that, contrary to traditional expectations, the NaCl structure is not present in covalent semiconductors, and the diatomic structure is absent in all compound semiconductors. We explain these systematic absences in terms of dynamical phonon instabilities of the NaCl and crystal structures. Covalent materials in the NaCl structure become dynamically unstable with respect to the transverse acoustic TA[001] phonon, while ionic compounds in the structure exhibit phonon instabilities in the longitudinal optical branch. The latter lead to predicted new high pressure phases of octet semiconductors.
- Received 23 July 1998
DOI:https://doi.org/10.1103/PhysRevLett.82.767
©1999 American Physical Society