[Pw_forum] How to integrate a particular PDOS column

[Haruhiko Dekura]

Dear Nand

You can integrate each PDOS files to obtain the total PDOS for selecting orbitals by using sumpdos.x. 

Below is the output of help message from sumpdos.x; 

./sumpdos.x -h
----------------------------------------
USAGE: sumpdos [-h] [-f <filein>] [<file1> ... <fileN>]
  Sum the pdos from the file specified in input and write the sum 
  to stdout
     -h           : write this manual
     -f <filein>  : takes the list of pdos files from <filein> 
                    (one per line) instead of command line
     <fileM>      : the M-th pdos file
---------------------------------------------

And see also user-guide. 



Hope this helps. 
Haruhiko Dekura

On 2010/07/23, at 14:47, nand wrote:

> Dear      Dr Sclauzero and PW users,
> Thanks for replying on my last query. Now i would like to know (as a new user) how to integrate a particular column of PDOS file . Is there a tool for that or is done using ones own program.
> Thanking you in advance.
> 
> Nand Rana
> Ranchi University.
> India 
> 
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum

-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.democritos.it/pipermail/pw_forum/attachments/20100723/bf9a64a4/attachment-0001.htm