[Pw_forum] calculation error about example12

Manoj Srivastava manoj at phys.ufl.edu
Mon Dec 8 15:17:36 CET 2008


Dear Chenweiguang, 
 The input file of example 12 is correct, at least in the version i am
using. I could run the example perfectly in version 4.0.1. Which version
are you using? Can you run any other examples?

Cheers, 
Manoj

 On Mon, 8 Dec 2008, Weiguang Chen wrote:

> Hi,
> 
> Another puzzle about example12 when I calculate the transmission of
> Al-wire, the last several lines of out-file is just as follows:
> 
>  E-Ef(ev), T(x2 spins) =    0.2500000   4.0000000
>   %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
> 
>      from gep_x : error #        38
> 
>      error on zggev
> 
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
> 
> 
> 
>      stopping ...
> 
> p0_24174:  p4_error: : 0
> 
>  the input files of example12 is right or not  , and is there any
> tricks about transmission calculation?
> 
>  Thanks very much
> 
> -- 
> Best Wishes
> ChenWeiguang
> 
> ************************************************
> #               Chen, Weiguang
> #
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> #
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