[Pw_forum] charge density cal.

Hadi Arefi hadi.arefi at tyndall.ie
Wed Feb 5 18:30:40 CET 2014

Dear Ehsan,

As it clearly says, there is something wrong with the input parameters you of pp.in.
For more help you need to provide your input file/files description.


From: pw_forum-bounces at pwscf.org [mailto:pw_forum-bounces at pwscf.org] On Behalf Of ehsan targholi
Sent: 05 February 2014 16:43
To: PWSCF Forum
Subject: [Pw_forum] charge density cal.

espresso users
i want to obtain the charge density of si in example 5. but when i use pp.x calculation with &inputpp namelist, after scf , give this error:

     Error in routine postproc (1):
     reading inputpp namelist

     stopping ...
 what is my mistake ?

best regard

ehsan targholi
graduate student of iust
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