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fleur
fleur
Commits
db45ba06
Commit
db45ba06
authored
Oct 02, 2019
by
Alexander Neukirchen
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Quickfix of fleur.F90
parent
73bbf6db
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main/fleur.F90
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db45ba06
...
...
@@ -106,7 +106,7 @@ CONTAINS
! local scalars
INTEGER
::
eig_id
,
archiveType
,
num_threads
INTEGER
::
iter
,
iterHF
,
i
,
n
INTEGER
::
iter
,
iterHF
,
i
LOGICAL
::
l_opti
,
l_cont
,
l_qfix
,
l_real
REAL
::
fix
#ifdef CPP_MPI
...
...
@@ -499,8 +499,9 @@ CONTAINS
! DIVERGENCE
CALL
divB
%
init
(
stars
,
atoms
,
sphhar
,
vacuum
,
noco
,
input
%
jspins
,
POTDEN_TYPE_DEN
)
DO
n
=
1
,
atoms
%
ntype
CALL
divergence
(
input
%
jspins
,
n
,
stars
%
kxc1_fft
*
stars
%
kxc2_fft
*
stars
%
kxc3_fft
,
atoms
,
sphhar
,
sym
,
stars
,
cell
,
vacuum
,
noco
,
xcB
,
divB
)
DO
i
=
1
,
atoms
%
ntype
CALL
divergence
(
input
%
jspins
,
i
,
stars
%
kxc1_fft
*
stars
%
kxc2_fft
*
stars
%
kxc3_fft
,
atoms
,
sphhar
,
sym
,
stars
,
cell
,
vacuum
,
noco
,
xcB
,
divB
)
END
DO
IF
((
sliceplot
%
iplot
.NE.
0
)
.AND.
(
mpi
%
irank
==
0
)
)
THEN
...
...
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