Structure symmetry (Indiiduals and online-utility: Multifingerprint)

18 views
Skip to first unread message

ansh...@gmail.com

unread,
Jun 12, 2025, 3:15:32 AMJun 12
to USPEX
Dear USPEX Team,

I have a question regarding the symmetry of the structure as reported in the 'Individuals' file of the results folder. Is the symmetry reported here is of the generated structure or the structure after relaxation?
When I use online-utilities (Multifingerprint) with 'gatheredPOSCARS' , it shows symmetry = 1 for all structures, while the corresponding structure in 'Individuals' file have a different symmetry.

Thanks and regards,
Anshu
Reply all
Reply to author
Forward
0 new messages