Modelling of interstitials in the bcc phase AITranslate

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DOI：https://doi.org/10.1016/j.calphad.2008.09.013

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There are several widespread thermodynamic datasets which produce a spurious bcc interstitial solution at high temperature and high X content (X is an interstitally dissolved element). The reason for this is the standard model for bcc interstitial solutions (M(V a,X)3), which requires careful selection of optimising parameters to minimise spurious appearances of the bcc phase. In this work the model M(V a,X)1 is suggested as an alternative. This model is much easier to handle and its parameters can be directly compared with those of the fcc phase. The two models are compared for the Fe–C and Nb–N systems. In the Fe–C system almost identical results are achieved. In Nb–N there are some differences for high N content, but there is no experimental data to clearly support any model.