[Pw_forum] paramagnetic defects in solids

Sanda Botis sandabotis at gmail.com
Thu Feb 26 21:47:12 CET 2009


Hi everyone,

I would like to know if anyone has experience working on paramagnetic
defects in solids and using QE. I know that the 4.0 version is supposed to
be able to calculate g-tensors and hyperfine constants but I am not sure how
well it works for solids and how computationally demanding this type of
calculations are.

Maybe you can give me a few suggestions based on your experience with QE.

Thank you,
Sanda
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