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Ebert-Daniel avatar Ebert-Daniel commented on May 29, 2024

Hello again Professor,

To be more precise, I'm having difficulties to calculate "step separate" when applying x(A)-x(B)=0 conditions. It seems to create a extra new "x(A)-x(B)=0" condition after I "step sep" and got the error. Even when I set level to advanced and change the BIT to not allow minimization. I also tried to set the grid density to "Very dense grid".
Specially for a 4 sublattice phase with solubility in the 2 last sublattices, I cannot even start the calculation. It has a miscibility gap due to interactions of two atoms in the last sublattice but I don't know if this is the problem.

Sorry for so many questions. I would very much appreciate to share the files with you by email.
Thank you again for your patience

Best wishes
Ebert

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sundmanbo avatar sundmanbo commented on May 29, 2024

Please send me the files by email, I have noticed the problem with conditions that are expressions but I have not had time to fix it and it is not used very much.

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sundmanbo avatar sundmanbo commented on May 29, 2024

I have updated the github version fixing the problem with condition x(a)-x(b)
If you have other problems please contact me directly by email

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sundmanbo avatar sundmanbo commented on May 29, 2024

I hope it works now

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