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- W2024578319 startingPage "8622" @default.
- W2024578319 abstract "We study the diffusion process via a vacancy mechanism in an A-$B$ binary alloy with $B2$ order. The starting point of our Monte Carlo simulations were experiments done recently by Mossbauer spectroscopy and nuclear resonant scattering on stoichiometric $B2$ ordered FeAl, which yielded a nonobvious jump model for the Fe atoms, namely a priority of effective jumps to third-nearest-neighbor sites over second-nearest-neighbor sites. In the simulations we chose ordering energies that ensured a phase diagram close to that of the real Fe-Al system. Allowing the vacancy to exchange with nearest-neighbor atoms exclusively, we obtained a perfect agreement between simulation and experiment for the case when an interaction between the vacancy and the atoms was included. We suggest that the remarkable features of Fe diffusion arise from highly correlated vacancy paths, which are due to an interaction of the vacancy with locally disordered areas in the $B2$ lattice created by the vacancy movement itself." @default.
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- W2024578319 date "1999-04-01" @default.
- W2024578319 modified "2023-10-18" @default.
- W2024578319 title "Monte Carlo simulations of Mössbauer spectra in diffusion investigations" @default.
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- W2024578319 doi "https://doi.org/10.1103/physrevb.59.8622" @default.
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