[Pw_forum] Reg: Is there any other option instead of increasing " nbnd " values in pwscf

Peram sreenivasa reddy peramsreenivas at gmail.com
Tue Feb 18 16:24:47 CET 2014


Dear Pwscf,

I am getting warning like as shown below in my case.ph.out file



Possibly too few bands at point   32   0.37500   0.37500   0.37500

Possibly too few bands at point   33   0.37500   0.37500  -0.50000

Possibly too few bands at point   34   0.37500  -0.50000  -0.50000

Possibly too few bands at point   35  -0.50000  -0.50000  -0.50000


Is there any other option instead of increasing " nbnd "  values in pwscf.
why because if i increase nbnd values optionally the calculations are time
taking.

Please suggest any other option.


thanking you
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20140218/eca9cbd3/attachment.html>


More information about the users mailing list