[Wien] inversion symmetry in the slab

[Oleg Artamonov]

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
>>
>>
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>
> -- 
>
>                                       P.Blaha
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> Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
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