A Linux distribution has a wealth of software included, but most of it
is not installed by default.
You have to install the the fftw library yourself. How this is done
depends on your Linux version.
Don't compile the mpi version of wien2k. It is not necessary with your
hardware of a single PC.
Am 17.05.2023 um 11:44 schrieb chethanv Research Scholar:
Both these files are not installed can you tell how to include this files or
can you share thi installed file.
libfftw3_mpi.alibfftw3_mpi.la <http://libfftw3_mpi.la>
On Wed, May 17, 2023 at 10:21 AM chethanv Research Scholar
<cheth...@physics.uni-mysore.ac.in> wrote:
Thank you for your email. I don't know what is the reason and
error about dstart , I am attaching the compile.msg please guide
me to install correctly
On Tue, May 16, 2023 at 9:38 PM chethanv Research Scholar
<cheth...@physics.uni-mysore.ac.in> wrote:
Thank you for your reply. I am attaching the compile.msg file
below please let me know how to resolve this issue.
On Tue, May 16, 2023 at 6:25 PM chethanv Research Scholar
<cheth...@physics.uni-mysore.ac.in> wrote:
I am running wien version 23.2 on a AMD Ryzen9 machine
with gcc fortran compilers.
I get the following error
error: command /home/admin123/WIEN2k_23/dstartpara dstart.def
failed
0.025u 0.002s 0:00.26 7.6% 0+0k 0+32io 0pf+0w
dstart: Command not found.
with best regards
Chethan V.
Junior Research Fellow
University of Mysore
Ph. No. 8050435657
_______________________________________________
Wien mailing list
Wien@zeus.theochem.tuwien.ac.at
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
SEARCH the MAILING-LIST
at:http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
--
-----------------------------------------------------------------------
Peter Blaha, Inst. f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-158801165300
Email:peter.bl...@tuwien.ac.at
WWW:http://www.imc.tuwien.ac.at WIEN2k:http://www.wien2k.at
-------------------------------------------------------------------------
_______________________________________________
Wien mailing list
Wien@zeus.theochem.tuwien.ac.at
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
SEARCH the MAILING-LIST at:
http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html