[Wien] boltztrap error

Gavin Abo gsabo at crimson.ua.edu
Fri Jun 6 16:14:48 CEST 2014


I think case.engre might be created by BoltzTraP when it is ran with 
CALC in case.intrans 
[http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg04755.html].

On 6/6/2014 7:06 AM, idris.09 idris wrote:
> Dear Wien2k users
>
> I am having a problem in running  boltztrap. i have installed the code 
> and the test runs are also running without any problem. when i tried 
> to run boltztrap i got the following error
>
> At line 132 of file m_bandstructure.F90 (unit = 48, file = 'Rumn.engre')
> Fortran runtime error: End of file
> 0.0u 0.0s 0:00.03 133.3% 0+0k 0+456io 0pf+0w
>
> 'Rumn' is my system.
>
> Further i am not able to find the 'case.engre' file in my previous 
> band structure calculations.
>
> Please help me to find the solution.
>
> With Regards
>
> Idris


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