[RMCProfile-users] Bragg fitting

[Lemuel Crentsil]

Dear all,

I am currently trying to use RMCProfile to do a refinement on x-ray data. I have used RMCProfile before and I'm familiar with the set up files etc..

With this refinement, I get a very poor Bragg fit that doesn't match the fit that I achieved with GSAS. I used get_gsas_bragg to extract the required files and used the .cif file exported from GSAS to create the supercell with rmc6f.

Any thoughts?

Lemuel
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.rmcprofile.org/pipermail/rmcprofile-users/attachments/20240617/b988df21/attachment.htm>