[gpaw-users] Help with dataset for Cerium

Prodyut Roy prodyut.chem at gmail.com
Tue Sep 24 07:09:32 CEST 2024


Hi everyone,
                    I am trying to do delta SCF calculations for a system
containing Cerium (Ce), but datasets of Ce are not present in the gpaw
library. How can I obtain the dataset for Ce? or, is there any way to
generate that?

Please reply.

Thanks in advance.

Prodyut
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