See the thread here for a recent post about using topas Bragg in RMCProfile.

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RMCProfile7 [Molecules List Setup]
#2
You can refer to the manual here, https://pv.iris-home.net/s/E0OTM5M for references about the molecule settings.

I think the molecule list file does not have to be there -- the program will be generating the file if it cannot be found.

One thing is the Mac version is not up-to-date so we do expect issues. If you can grab a windows machine, you can use the up-to-date version available via the Dropbox folder for the total scattering school.

We will be working on compiling the program for all platforms soon and I will post a message here once it is available.
--

Dr. Yuanpeng Zhang
Neutron Scattering Scientist, ORNL
Web: https://www.iris2020.net
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RMCProfile7 [Molecules List Setup] - by kewh5868 - 06-28-2024, 05:47 PM
RE: RMCProfile7 [Molecules List Setup] - by y8z-admin - 06-28-2024, 06:11 PM

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