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Small change suggested by Guido F. 

Paolo


git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@13181 c92efa57-630b-4861-b058-cf58834340f0
This commit is contained in:
giannozz 2016-11-25 10:21:51 +00:00
parent 57fdf2f9ad
commit 705128c0a6
2 changed files with 5 additions and 3 deletions
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6
PP/Doc/INPUT_PROJWFC.def
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@ -66,8 +66,10 @@ input_description -distribution {Quantum Espresso} -package PWscf -program projw
var lsym -type LOGICAL {
default { .true. }
info {
if .true. the projections are symmetrized
if .false. partial density of state cannot be computed
if .true. the projections are symmetrized,
the partial density of states are computed
if .false. the projections are not symmetrized, the partial
DOS can be computed only in the k-resolved case
}
}

2
PP/src/projwfc.f90
View File

@ -192,7 +192,7 @@ ELSE
IF ( ionode ) THEN
IF ( tdosinboxes ) THEN
CALL partialdos_boxes (Emin, Emax, DeltaE, kresolveddos, filpdos, n_proj_boxes)
ELSE IF ( lsym ) THEN
ELSE IF ( lsym .OR. kresolveddos ) THEN
IF (noncolin) THEN
CALL partialdos_nc (Emin, Emax, DeltaE, kresolveddos, filpdos)
ELSE