Kd. Belashchenko et Vg. Vaks, SEGREGATION OF IMPURITIES AND VACANCIES ON PHASE AND ANTIPHASE BOUNDARIES IN ALLOYS, Journal of experimental and theoretical physics, 85(2), 1997, pp. 390-398
The equilibrium distribution of low-concentration impurities or vacanc
ies is investigated in the region of a coherent phase boundary or anti
phase boundary in a binary alloy. A general expression for the free en
ergy of an inhomogeneous multicomponent alloy, which generalizes the e
xpression previously derived for a binary alloy, is presented. Explici
t formulas for the impurity concentration profile c(im)(x) in terms of
the distribution of the principal components of the alloy near a boun
dary are obtained from this expression in the mean-field and pair-clus
ter approximations. The shape of this profile is determined by a ''pre
ference potential'' P, which characterizes the attraction of an impuri
ty to one of the alloy components, as well as by the temperature T and
the phase transition temperature T-c. At small values of PIT impuriti
es segregate on a phase boundary, and the degree of this segregation,
i.e, the height of the maximum of ci,(x), in the region of the boundar
y increases exponentially as the ratio T,IT increases. For P not equal
0 the c(im)(x) profile near a phase boundary is asymmetric, and as PI
T increases, it takes on the form of a ''worn step.'' The maximum on t
he c(im)(x) curve then decreases, and at a certain \P\greater than or
similar to T-c it vanishes. Segregation on an antiphase boundary is in
vestigated in the case of CuZn ordering in a bcc alloy. The form of c(
im)(x) near an antiphase boundary depends significantly both on the fo
rm of the potential P and on the stoichiometry of the alloy. At small
P impurities segregate on an antiphase boundary, and at fairly large P
''antisegregation,'' i.e., a decrease in the impurity concentration o
n the antiphase boundary in comparison with the value within the antip
hase domains, is also possible. (C) 1997 American Institute of Physics
.