ON THE INTERATOMIC CORRELATIONS AND MEAN-SQUARE RELATIVE ATOMIC DISPLACEMENTS IN AN ANHARMONIC MODEL OF THE CLOSE-PACKED CRYSTAL

Citation
Vi. Zubov et al., ON THE INTERATOMIC CORRELATIONS AND MEAN-SQUARE RELATIVE ATOMIC DISPLACEMENTS IN AN ANHARMONIC MODEL OF THE CLOSE-PACKED CRYSTAL, Modern physics letters B, 9(14), 1995, pp. 839-847
Citations number
16
Categorie Soggetti
Physics, Applied","Physics, Condensed Matter","Physycs, Mathematical
Journal title
ISSN journal
02179849
Volume
9
Issue
14
Year of publication
1995
Pages
839 - 847
Database
ISI
SICI code
0217-9849(1995)9:14<839:OTICAM>2.0.ZU;2-X
Abstract
The correlative method of unsymmetrized self-consistent field (CUSF) i s used to study the interatomic correlations and mean square displacem ents in anharmonic crystals. In the first order of CUSF we have derive d the formula for the atomic mean square displacement and quadratic co rrelation between displacements of two nearest neighbors along the lin e passing through their centers C-xx(1) = nq(x)(2)/Z where n is the di mensionality of a lattice and Z is the coordinational number. In the s econd order of CUSF we have calculated the quadratic correlation momen ts and mean square relative displacements in the two-dimensional model of an anharmonic crystal with hexagonal lattice. The results are comp ared with those for square lattice obtained previously.