Hi Hari Paudyal.
Thanke for your suggestion! it's very usefull. but the ifc.q2r file has already
exist.
shaofei wang
-Original Messages-
From:"Hari Paudyal via users"
Sent Time:2021-08-19 10:08:31 (Thursday)
To: "Quantum ESPRESSO users Forum"
Cc:
Subject: Re: [QE-users] [External Em
Hi ShaoFei Wang,
It looks like you do not have an interatomic force constant file (file name
should be ifc.q2r) saved in the 'save' directory where you have dyn and
dvscf files.
For the EPW related problems, I would recommend posting on
https://forum.epw-code.org/ and an expert will definitely h
Hi Paolo
This problem was missed when i changed the q points number in phonon
calculation. but i confront with another problems
Symmetries of small group of q: 12
in addition sym. q -> -q+G:
Number of q in the star =1
List of q in the star:
1 0.0
Hi Paolo,
From the source code, I think "-ntg" now requires switching from slab to
pencil decomposition using the
undocumented switch "-pd"?
exactly so
Right, thanks.
What are the implications of this method selection? Is one "better" or
"worse" than the other, whatever that m
