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sundmanbo avatar sundmanbo commented on June 12, 2024

Hi EA

The problem is easy to solve, in your TDB file you must add that the BCC_B2 phase is magnetic. In TC that is set automatically when the BCC_A2 is magnetic but in OC the treatment of "disordered fraction sets" is different. Thus add a line
TYPE_DEFINITION M GES A_P_D BCC_B2 MAGNETIC -1.0 4.00000E-01 !
and add M to the line PHASE BCC_B2 %/M .....

Mapping in OC is sensitive to the start point, best to start at x(ti)=.7 and T=1000 in the miscibility gap for BCC. You will also need a separate start point to calculate the gamma loop.

Best wishes

Bo

from opencalphad.

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