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- Fri Jun 26, 2020 1:06 pm
- Forum: Response calculations
- Topic: Full DFPT of Raman Scattering
- Replies: 1
- Views: 7584
Full DFPT of Raman Scattering
Hi, I'm trying to do a full DFPT calculation of the Raman scattering of ZnO. I have run a 7 data set calculation incorporating usepead=0 and trying to follow the examples in t81-t89.in The calculation runs successfully, but I get an error using anaddb to extract the raman tensor. The error says that...