On. Mryasov et al., GENERALIZED STACKING-FAULT ENERGETICS AND DISLOCATION PROPERTIES - COMPACT VERSUS SPREAD UNIT-DISLOCATION STRUCTURES IN TIAL AND CUAU, Physical review. B, Condensed matter, 58(18), 1998, pp. 11927-11932
We present a general scheme for analyzing the structure and mobility o
f dislocations based on solutions of the Peierls-Nabarro model with a
two component displacement field and restoring forces determined from
the ab initio generalized stacking fault energetics (i.e., the so-call
ed gamma surface). The approach is used to investigate dislocations in
L1(0) TiAl and CuAu; predicted differences in the unit dislocation pr
operties are explicitly related with features of the gamma-surface geo
metry. A unified description of compact, spread and split dislocation
cores is provided with an important characteristic ''dissociation path
'' revealed by this highly tractable scheme. [S0163-1829(98)03342-6].