[QE-users] Error in electron phonon calculation

Mayuri Bora mayu219 at tezu.ernet.in
Sat Dec 18 11:51:24 CET 2021


Dear QE users,

I am trying to calculate the electron-phonon coupling parameter for
semimetal-ferromagnet semiconductor system in QE-6.7 with 22 no.of atoms
in the unit cell for 4 4 1 q points. Initially the calculation runs upto 2
q-point but when it stops then i have given the recover = .true. so that
it restart from the previously stopped q point. In this regard, i have
found an error of

Saving dvscf to file. Distribute only q points, not irreducible
represetations.
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found
ers at lists.quantum-espresso.orgarning: file closed at level 1 with tag Root
open
 end of file reached, closing tag not found
warning: file closed at level 1 with tag Root open
 end of file reached, closing tag not found

Error in routine lint (6):
     cannot locate  k point  xk

May I know what is the reason behind this error.

regards
Mayuri


Mayuri Bora
INSPIRE Fellow
Advanced Functional Material Laboratory
Tezpur University
Napaam
http://www.tezu.ernet.in/afml/


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