Y. Kamimura et al., CALCULATIONS OF POSITRON LIFETIMES IN A JOG AND VACANCIES ON AN EDGE-DISLOCATION LINE IN FE, Physical review. B, Condensed matter, 52(2), 1995, pp. 879-885
The lifetimes of positrons in an edge dislocation, a jog, and vacancie
s, which are associated with the edge dislocation (associated vacancy)
, in bcc iron are calculated. The structures of the defects are obtain
ed by static relaxation using the Finnis-Sinclair potential. The posit
ron lifetimes are calculated using the superimposed-atom method, which
was developed by Push and Nieminen. The positrons are not localized s
trongly in the pure edge dislocation and the jog. The lifetimes in the
m are almost the same, and are only a few picoseconds longer than in t
he matrix. The vacancy is trapped on the edge-dislocation line, and is
not collapsed completely by the strain in the core region of the disl
ocation. The positron lifetime in the associated vacancy is shorter th
an that in a vacancy in the matrix, and is compared to the experimenta
l value observed in deformed iron. These results indicate that the dee
per trap associated with the dislocation line is not the jog but the v
acancy.