[Wien] inversion symmetry in the slab

[Peter Blaha]

As discussed before on this list, you don't need to break inversion for
that purpose.

Oleg Artamonov schrieb:
> Dear Peter Blaha,
> 
> I expect to find the spin-splitting due to spin-orbit interaction (Rashba 
> effect). Oleg.
> 
> 
> ----- Original Message ----- 
> From: "Peter Blaha" <pblaha at theochem.tuwien.ac.at>
> To: "A Mailing list for WIEN2k users" <wien at zeus.theochem.tuwien.ac.at>
> Sent: Friday, October 03, 2008 3:52 PM
> Subject: Re: [Wien] inversion symmetry in the slab
> 
> 
>> Why would you like to do that ?
>>
>> All the results should be identical.
>>
>> Oleg Artamonov schrieb:
>>> Dear Wien2k users,
>>>
>>> I am calculating a 7-layer slab of W(110). What is the best way to remove
>>> the inversion symmetry from my structure?
>>>
>>> Thank you,
>>>                     Oleg Artamonov
>>>
>>>
>>> _______________________________________________
>>> Wien mailing list
>>> Wien at zeus.theochem.tuwien.ac.at
>>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>> -- 
>>
>>                                       P.Blaha
>> --------------------------------------------------------------------------
>> Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
>> Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
>> Email: blaha at theochem.tuwien.ac.at    WWW: 
>> http://info.tuwien.ac.at/theochem/
>> --------------------------------------------------------------------------
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> 
> 
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-- 

                                       P.Blaha
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
--------------------------------------------------------------------------