Long-range forces and the moments method
- 15 June 1991
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 43 (17) , 14255-14256
- https://doi.org/10.1103/physrevb.43.14255
Abstract
A recent theory of angular forces in covalent solids, as arising from the fourth moment of the bands, was tested by comparison of the predicted elastic shear constant (-)/2 with experiment. (A small error in the magnitude of that prediction is corrected here.) Though the comparison gave a discrepancy of a factor of nearly 4, we find here that the corresponding prediction of a zone-face transverse-acoustic vibrational frequency is in quite good accord with experiment. It is argued here that the moment theory does give a good description of the short-range angular forces, which determine the vibrational frequency, and that the discrepancy for (-)/2 came from the neglect of long-range forces that enter this property. This suggests serious inherent limitations in any short-range-force model of covalent solids.
Keywords
This publication has 3 references indexed in Scilit:
- Interatomic interactions in covalent and ionic solidsPhysical Review B, 1990
- Computer simulation of local order in condensed phases of siliconPhysical Review B, 1985
- Effect of Invariance Requirements on the Elastic Strain Energy of Crystals with Application to the Diamond StructurePhysical Review B, 1966