[Pw_forum] EPR g tensor calculation

[Davide Ceresoli]

wangxinquan wrote:
> Dear all:
>     I am about to calculate g tensor of EPR using espresso package,but I 
> do not
>  know the keywords of the input file how to obtain (Only NMR examples for
> gipaw.x).Is there some examples?
>    Thank you for your attention!
>   
It is in the documentation (doc/INPUT_GIPAW.def):
&inputgipaw
	job='g_tensor'
	....
/

Provided you use gipaw-pseudopotentials, this is all!

Davide


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  Davide Ceresoli <ceresoli at mit.edu>
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