[Wien] spin orbit calculation (problem with Wien2k_10)

Stefaan Cottenier Stefaan.Cottenier at UGent.be
Sun Oct 24 17:58:43 CEST 2010


> I tried the Wien2k 10 the same error I face
>
> forrtl: severe (64): input conversion error, unit 5, file /root/WIEN2k/wien10_test/test2/test2.inso

> the file is in attachments
> I just work with FCC structure so I make the direction
> of magnetization in the plane  1  1   1
> my structure is FeN     FCC   it is a test of spin orbit calculation
> I fail till now , this is my first test

The answer is here, as said before :

>>     What about reading the UG ?

For instance, Sec. 7.4.3, page 96, description of line 5.

Stefaan


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