[Wien] Regarding WIEN2K

[delamora]

Once I heard; 
        The best code is the code that you know best

________________________________________
De: wien-bounces at zeus.theochem.tuwien.ac.at <wien-bounces at zeus.theochem.tuwien.ac.at> en nombre de Peter Blaha <pblaha at theochem.tuwien.ac.at>
Enviado: viernes, 15 de abril de 2016 07:50 a. m.
Para: A Mailing list for WIEN2k users
Asunto: Re: [Wien] Regarding WIEN2K

There are MANY very good codes out on the market, both with
pseudopotentials and all-electrons.

All codes have there advantages AND disadvantages and therefore it is
good if one (usually the supervisor) knows the merrits of the different
methods/codes.

In any case, I always say: the best code is the code, which you can
master, because in 99% of the cases a code could do the job, but you do
not know how to do it with this particular code.

WIEN2k is generally believed to be a fairly user-friendly code and has
reasonable default input settings. In addition it has a mailing list
where one can ask questions like this.


On 04/14/2016 06:31 PM, sikander Azam wrote:
> Dear sir Petr Blaha and others
> Why FOR FPLAPW method WIEN2K code is preferred than other FP codes like
> fleur code and others.
> Regards
> Sikander
>
>
>
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>

--

                                       P.Blaha
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300             FAX: +43-1-58801-165982
Email: blaha at theochem.tuwien.ac.at    WIEN2k: http://www.wien2k.at
WWW:   http://www.imc.tuwien.ac.at/staff/tc_group_e.php
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