[Wien] BoltzTrap

[Gerhard Fecher]

Sorry,
I did not see the correct link on Georgs webpage, it is
http://www.icams.de/content/departments/ams/madsen/boltztrap.html

Ciao
Gerhard

====================================
Dr. Gerhard H. Fecher
Institut of Inorganic and Analytical Chemistry
Johannes Gutenberg - University
55099 Mainz
________________________________________
Von: wien-bounces at zeus.theochem.tuwien.ac.at [wien-bounces at zeus.theochem.tuwien.ac.at]" im Auftrag von "Peter Blaha [pblaha at theochem.tuwien.ac.at]
Gesendet: Montag, 16. Mai 2011 09:18
Bis: A Mailing list for WIEN2k users
Betreff: Re: [Wien] BoltzTrap

The Botztrap link at the "unsupported software" page is working !
(http://www.wien2k.at/reg_user/unsupported/)

I recommend this version, because it points to an updated version
of Botztrap.

Am 16.05.2011 08:37, schrieb Gerhard Fecher:
> Boltztrap is not a part of Wien2k and it seems that the Link on the Unsupported software page does not point to Boltztrap anymore.
>
> You may download it alternatively from Computer Physics Communications Code: ADXU
> (see Computer Physics Communications 175 (2006) 67–71)
> Program summary URL: http://cpc.cs.qub.ac.uk/summaries/ADXU_v1_0
>
>
> Ciao
> Gerhard
>
> ====================================
> Dr. Gerhard H. Fecher
> Institut of Inorganic and Analytical Chemistry
> Johannes Gutenberg - University
> 55099 Mainz
> ________________________________________
> Von: wien-bounces at zeus.theochem.tuwien.ac.at [wien-bounces at zeus.theochem.tuwien.ac.at]" im Auftrag von"Ramkumar Thapa [r.k.thapa at gmail.com]
> Gesendet: Montag, 16. Mai 2011 06:03
> Bis: A Mailing list for WIEN2k users
> Betreff: Re: [Wien] BoltzTrap
>
> Der users of wien2k, can BoltzTranp code be downloaded by registered users.
>
> 2011/5/15 Mojtaba Zareii<smojtaba.zareii at gmail.com<mailto:smojtaba.zareii at gmail.com>>
> Hi dear WIEN2K users
> I was going to use WIEN2K’s results to study the transport properties of Al by BotzTrap code . So I needed  three files, i.e. “case.struct” , “case.intrans” and “case.energy” as input files for this program.
> I could create “case.struct” , “case.intrans” files properly as explained by BoltzTrap UserGuide (Readme file), but I don’t know how to create “case.energy” file.
> Could you please help me with this question?
> Dr.K.Parker
>
>
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--

                                       P.Blaha
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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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