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Electronic Theory of Atomic Short‐Range Order for Ternary Alloys Using the Pseudopotential Approximation and Its Comparison with Experiments
Author(s) -
Mekhrabov Amdulla O. O.,
Doyama M.
Publication year - 1984
Publication title -
physica status solidi (b)
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.51
H-Index - 109
eISSN - 1521-3951
pISSN - 0370-1972
DOI - 10.1002/pssb.2221260203
Subject(s) - pseudopotential , ternary operation , range (aeronautics) , order (exchange) , condensed matter physics , materials science , short range order , density functional theory , electronic structure , atomic physics , thermodynamics , chemistry , physics , computational chemistry , finance , computer science , economics , composite material , programming language
An analysis of the electronic theory of atomic short‐range ordering for ternary alloys in the pseudopotential approximation is made. The partial ordering energies and short‐range order parameters are calculated for ternary NiReMo, Ni 3 ,(Fe 0.10 , Cr 0.15 ), and Ni 3 (Fe 0.20 , Mn 0.05 ) alloys using the model pseudopotential of Animalu. The comparison of the results between calculated and measured shows a good agreement for all the chosen systems.