[GSAS-II] Unable to index magnetic reflections

אלעד כספי eladc at iaec.gov.il
Sun Mar 29 01:49:40 CDT 2026


Thank you for your answer.
However, I believe the answer was targetted at issue #1 in my mail. Issue
#2 deals with manually (without Bilbao) adding a magnetic phase. In
this case, I am unable to see the (new) indices related with the magnetic
phase when I try to see what magnetic symmetry fits the reflection. Is this
being handled as well?
El'ad

On Sat, Mar 28, 2026 at 9:50 PM Toby, Brian H. via GSAS-II <
gsas-ii at aps.anl.gov> wrote:

> This is still not working. See
> https://urldefense.us/v3/__https://github.com/AdvancedPhotonSource/GSAS-II/discussions/294__;!!G_uCfscf7eWS!dAGPvWEPQ9jhfaPz4i2hQbcvSDpZ_rUwfnjsuMi3EG7pIo0GirCqaQqIKGLBF2shGh25rcMk4T1yEZCU5lI$ 
> <https://urldefense.us/v3/__https://gcc02.safelinks.protection.outlook.com/?url=https*3A*2F*2Fgithub.com*2FAdvancedPhotonSource*2FGSAS-II*2Fdiscussions*2F294&data=05*7C02*7Cgsas-ii*40aps.anl.gov*7Ce35b49903f744e8fe09b08de8cfad8f1*7C0cfca18525f749e38ae7704d5326e285*7C0*7C0*7C639103206190576010*7CUnknown*7CTWFpbGZsb3d8eyJFbXB0eU1hcGkiOnRydWUsIlYiOiIwLjAuMDAwMCIsIlAiOiJXaW4zMiIsIkFOIjoiTWFpbCIsIldUIjoyfQ*3D*3D*7C0*7C*7C*7C&sdata=bPZPEsRoX0aQ2g*2F*2BBoSMQvhIM9lb1uweSBMlYBY9ACc*3D&reserved=0__;JSUlJSUlJSUlJSUlJSUlJSUlJSUlJSUlJSU!!G_uCfscf7eWS!cXVt_DdgtRkkHMYb42g-II5tsYKJHf1Ks9E3Q7FP0OwOBmPZ2Jey-kkaGOb0QIfDYAWGx6qNetT0FZk$> and
> https://urldefense.us/v3/__https://github.com/AdvancedPhotonSource/GSAS-II/issues/313__;!!G_uCfscf7eWS!dAGPvWEPQ9jhfaPz4i2hQbcvSDpZ_rUwfnjsuMi3EG7pIo0GirCqaQqIKGLBF2shGh25rcMk4T1yFpMu3kg$ 
> <https://urldefense.us/v3/__https://gcc02.safelinks.protection.outlook.com/?url=https*3A*2F*2Fgithub.com*2FAdvancedPhotonSource*2FGSAS-II*2Fissues*2F313&data=05*7C02*7Cgsas-ii*40aps.anl.gov*7Ce35b49903f744e8fe09b08de8cfad8f1*7C0cfca18525f749e38ae7704d5326e285*7C0*7C0*7C639103206190604901*7CUnknown*7CTWFpbGZsb3d8eyJFbXB0eU1hcGkiOnRydWUsIlYiOiIwLjAuMDAwMCIsIlAiOiJXaW4zMiIsIkFOIjoiTWFpbCIsIldUIjoyfQ*3D*3D*7C0*7C*7C*7C&sdata=zBya*2F6GNqTvJyFhNKzsPt0WYEZIX8naz0EIlHDD7HU0*3D&reserved=0__;JSUlJSUlJSUlJSUlJSUlJSUlJSUlJSUlJQ!!G_uCfscf7eWS!cXVt_DdgtRkkHMYb42g-II5tsYKJHf1Ks9E3Q7FP0OwOBmPZ2Jey-kkaGOb0QIfDYAWGx6qNz-bYYt4$> for
> why and some workarounds. The good news is that this is being worked on,
> with software being updated both in GSAS-II and Bilbao, so there is some
> hope that this will be fixed pretty soon.
>
> Brian
>
> *From: *GSAS-II <gsas-ii-bounces at aps.anl.gov> on behalf of אלעד כספי via
> GSAS-II <gsas-ii at aps.anl.gov>
> *Date: *Saturday, March 28, 2026 at 1:20 PM
> *To: *gsas-ii at aps.anl.gov <gsas-ii at aps.anl.gov>
> *Subject: *[GSAS-II] Unable to index magnetic reflections
>
> This Message Is From an External Sender
> This message came from outside your organization.
>
> Hello,
> I am a new user to GSAS-II (and a very "old" user of GSAS/EXPGUI).
> I plan to use it mostly for magnetic structure refinement.
> I have 2 issues:
> 1. The request for magnetic symmetry from Bilbao Crystallographic center
> doesn't work. I understand that this issue is in the process of being
> solved.
> 2. When I add a magnetic phase "by hand" the indexing part doesn't work.I
> go to the "Unit Cells List", check the "magnetic?" box and play with the
> "red"/"black" options of the desired magnetic phase diagram. I do that for
> the LaMnO3 simple magnetic structure analysis example given in GSAS-II
> site. However, nothing changes. No additional indexing appears in the plot
> window. When I change the crystallographic (not magnetic) space group, the
> indexing do change accordingly.
>
> I am using version 5833/v5.7.4
>
> Thank you,
> El'ad
> _______________________________________________
> GSAS-II mailing list
> GSAS-II at aps.anl.gov
> https://mailman.aps.anl.gov/mailman/listinfo/gsas-ii 
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