F. Zhang et al., EQUIVALENCE OF THE GENERALIZED BOND-ENERGY MODEL, THE WAGNER-SCHOTTKY-TYPE MODEL AND THE COMPOUND-ENERGY MODEL FOR ORDERED PHASES, Calphad, 21(3), 1997, pp. 337-348
The equivalence of three thermodynamic models used in the literature t
o describe the compositional and temperature dependencies of the therm
odynamic properties of ordered intermetallic phases is presented. The
three models are the generalized bond-energy model, the Wagner-Schottk
y-type model and the compound-energy model. Equations to convert the m
odel parameters of the generalized bond-energy model to those of the o
ther two models are derived. The validity of these equations is demons
trated by showing the successful conversion of the model parameters fo
r the ordered phases in the To-Al system from the generalized bond-ene
rgy model to those of the Wagner-Schottky-type model and the compound-
energy model. However, conversion of the model parameters from these t
wo models to the generalized bond energy model is generally not possib
le due to additional constraints imposed in developing the later model
.