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elsi-devel
elsi-interface
Commits
93b3a79a
Commit
93b3a79a
authored
Jun 15, 2020
by
Victor Yu
Browse files
Output info when ELPA in GPU or float mode
Default is CPU and double precision.
parent
5d01d42b
Changes
2
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CMakeLists.txt
View file @
93b3a79a
...
...
@@ -7,7 +7,7 @@ SET(elsi_URL "http://elsi-interchange.org")
SET
(
elsi_EMAIL
"elsi-team@duke.edu"
)
SET
(
elsi_LICENSE
"BSD 3"
)
SET
(
elsi_DESCRIPTION
"Electronic Structure Infrastructure"
)
SET
(
elsi_DATESTAMP
"2020061
2
"
)
SET
(
elsi_DATESTAMP
"2020061
5
"
)
### CMake modules ###
LIST
(
APPEND CMAKE_MODULE_PATH
${
PROJECT_SOURCE_DIR
}
/cmake
)
...
...
src/elsi_elpa.f90
View file @
93b3a79a
...
...
@@ -358,7 +358,19 @@ subroutine elsi_solve_elpa_real(ph,bh,ham,ovlp,eval,evec)
call
elsi_check_ovlp_elpa
(
ph
,
bh
,
ovlp
,
eval
,
evec
)
end
if
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver"
if
(
ph
%
elpa_gpu
==
1
)
then
if
(
ph
%
n_calls
<=
ph
%
elpa_n_single
)
then
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver (GPU single precision)"
else
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver (GPU)"
end
if
else
if
(
ph
%
n_calls
<=
ph
%
elpa_n_single
)
then
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver (single precision)"
else
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver"
end
if
end
if
call
elsi_say
(
bh
,
msg
)
! Transform to standard form
...
...
@@ -729,7 +741,19 @@ subroutine elsi_solve_elpa_cmplx(ph,bh,ham,ovlp,eval,evec)
call
elsi_check_ovlp_elpa
(
ph
,
bh
,
ovlp
,
eval
,
evec
)
end
if
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver"
if
(
ph
%
elpa_gpu
==
1
)
then
if
(
ph
%
n_calls
<=
ph
%
elpa_n_single
)
then
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver (GPU single precision)"
else
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver (GPU)"
end
if
else
if
(
ph
%
n_calls
<=
ph
%
elpa_n_single
)
then
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver (single precision)"
else
write
(
msg
,
"(A)"
)
"Starting ELPA eigensolver"
end
if
end
if
call
elsi_say
(
bh
,
msg
)
! Transform to standard form
...
...
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