mirror of https://gitlab.com/QEF/q-e.git
Removed the check on npert <= 6. There are cases in which it could be larger.
git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@7201 c92efa57-630b-4861-b058-cf58834340f0
This commit is contained in:
parent
b8d28952a9
commit
9dc5e24a51
|
@ -259,7 +259,6 @@ subroutine set_irr (nat, at, bg, xq, s, sr, tau, ntyp, ityp, ftau, invs, nsym, &
|
|||
if (abs (eigen (imode) - eigen (imode-1) ) / (abs (eigen (imode) ) &
|
||||
+ abs (eigen (imode-1) ) ) .lt.1.d-4) then
|
||||
npert (nirr) = npert (nirr) + 1
|
||||
if (npert (nirr) .gt. 6) call errore('set_irr', 'npert > 6 ', nirr)
|
||||
else
|
||||
nirr = nirr + 1
|
||||
npert (nirr) = 1
|
||||
|
|
Loading…
Reference in New Issue