I just installed oneAPI today (it is free !!!). You need the Base and
the HPC (high performance computing) toolkit.
It was trivial to install, but the setting of the environment is
slightly different.
Once installed, WIEN2k compiles with the standard option (ifort+mkl)
without any changes.
Am 11.03.2021 um 16:52 schrieb Laurence Marks:
Since nobody has responded, I will. I have oneAPI running without any
issue for some months. Of course sometimes the installation is tricky.
I suggest going ahead, then coming back to the list if there are any
problems.
On Wed, Mar 10, 2021 at 12:38 AM Riyajul Islam <riyaju...@gmail.com
<mailto:riyaju...@gmail.com>> wrote:
Dear Wien2k users,
I have used Intel parallel studio for intel fortran compiler to
install Wien2k 19.2 but the license has expired. As they have
recently transitioned from Intel Parallel Studio XE to Intel
oneAPI, so is there any way that I can install Wien2k using Intel
oneAPI?
Kind regards
--
Riyajul Islam
National Institute of Technology Nagaland
_______________________________________________
Wien mailing list
Wien@zeus.theochem.tuwien.ac.at
<mailto:Wien@zeus.theochem.tuwien.ac.at>
https://urldefense.com/v3/__http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien__;!!Dq0X2DkFhyF93HkjWTBQKhk!FKkETL-5jLbLm0qQ0ojSzxyA70Chd3yLLZAlh9Yi1WoJ-qZ4aVzufokABoC7A10Jr6LDlw$
<https://urldefense.com/v3/__http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien__;!!Dq0X2DkFhyF93HkjWTBQKhk!FKkETL-5jLbLm0qQ0ojSzxyA70Chd3yLLZAlh9Yi1WoJ-qZ4aVzufokABoC7A10Jr6LDlw$>
SEARCH the MAILING-LIST at:
https://urldefense.com/v3/__http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html__;!!Dq0X2DkFhyF93HkjWTBQKhk!FKkETL-5jLbLm0qQ0ojSzxyA70Chd3yLLZAlh9Yi1WoJ-qZ4aVzufokABoC7A12B24_idA$
<https://urldefense.com/v3/__http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html__;!!Dq0X2DkFhyF93HkjWTBQKhk!FKkETL-5jLbLm0qQ0ojSzxyA70Chd3yLLZAlh9Yi1WoJ-qZ4aVzufokABoC7A12B24_idA$>
--
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu <http://www.numis.northwestern.edu/>
"Research is to see what everybody else has seen, and to think what
nobody else has thought" Albert Szent-Györgyi
_______________________________________________
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