[Pw_forum] How to perform density of states calculation

[Vishal Gupta]

Dear Mr. Brahma,
Actually I cant understand how the input files should be named. Lets
suppose this is the input file for Dos calculation :-
 &DOS
                      prefix = '0' ,
                      outdir = '/home/vishalgupta' ,
                      fildos = '0' ,
                      ngauss = 0 ,
                      DeltaE = 0.01 ,
 /

So the pw.x input file for which we want to calculate Dos, how should it be
named ?
0.pw.in  or  0.in

Thank You
Vishal

On Thu, Oct 8, 2015 at 8:11 AM, Bramha Pandey <pandey.bramha at gmail.com>
wrote:

> Dear vishal,
> Until you wouldn't give info about your system, hardly anyone can help.
> Major problem due to wrong input file parameters are responsible or out
> directory may be read write problem...anything.
> On 08-Oct-2015 12:55 AM, "Vishal Gupta" <vishal.gupta at iitrpr.ac.in> wrote:
>
>> I've been trying to perform a Dos calculation but it gives this error
>> every time :-
>> __________________________
>> error in routine pw_readfile (1):
>> error opening xml data file.
>> __________________________
>> Can somebody please tell me how to perform Dos calculation for a pw.x
>> input file way.in ?
>> Thank you.
>> Vishal Gupta
>> B.Tech. 3rd year Mechanical
>> Indian Institute of Technology Ropar
>> Rupnagar (140001), Punjab, India.
>>
>> _______________________________________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20151008/0ae22002/attachment.html>