You need both, MKL is part of "Intel® oneAPI Base Toolkit". Le 12/10/2021 à 13:24, Victor Zenou a écrit : > Thanks > Does Intel® oneAPI HPC Toolkit include mkl? > or I need both? > > > בתאריך יום ג׳, 12 באוק׳ 2021 ב-14:20 מאת David Sanchez > <david.sanc...@irsamc.ups-tlse.fr>: >> >> Hello Victor, >> >> mkl is part of "Intel® oneAPI Base Toolkit", but fortran is part of >> "Intel® oneAPI HPC Toolkit" >> >> Regards, >> >> Le 12/10/2021 à 13:12, Victor Zenou a écrit : >>> Dear all >>> >>> I’m trying to install WIEN2k_21.1 on Ubuntu 21.04. >>> >>> I updated and installed few system packages: >>> >>> sudo apt update >>> >>> sudo apt install build-essential gcc-multilib rpm default-jre-headless >>> python tcsh gnuplot >>> >>> sudo apt install autoconf libtool ghostscript octave >>> >>> >>> I downloaded and installed “Intel® oneAPI Base Toolkit” which suppose >>> to have ifort complier and mkl. I also add a line to bashrc: >>> >>> source /opt/intel/oneapi/setvars.sh >>> >>> >>> >>> The command “ifort -v”, gives “Command 'ifort' not found,...” >>> >>> >>> ./siteconfig_lapw give the following message: >>> >>> It seems you do not have the intel fortran compiler in your path. >>> >>> >>> So it seems that my intel compiler either dio not exist or not in the path. >>> >>> How can I check that/ >>> >>> >>> Any suggestions on how to proceed? >>> >>> >>> Best regards, victor Zenou >>> _______________________________________________ >>> 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 >>> >> >> >> -- >> David Sanchez >> UNIVERSITÉ TOULOUSE III - Paul Sabatier >> Faculté des Sciences et d'Ingénierie >> Laboratoire de Chimie et Physique Quantique (LCPQ) >> Bâtiment 3R1 b4 - 2e étage - Bureau 225 >> 118 route de Narbonne >> 31062 Toulouse cedex 09 >> Tél : +33.5.61.55.63.97 (privilégier le mail) >> Web : https://www.lcpq.ups-tlse.fr/ >> _______________________________________________ >> 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 > _______________________________________________ > 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 >
-- David Sanchez UNIVERSITÉ TOULOUSE III - Paul Sabatier Faculté des Sciences et d'Ingénierie Laboratoire de Chimie et Physique Quantique (LCPQ) Bâtiment 3R1 b4 - 2e étage - Bureau 225 118 route de Narbonne 31062 Toulouse cedex 09 Tél : +33.5.61.55.63.97 (privilégier le mail) Web : https://www.lcpq.ups-tlse.fr/ _______________________________________________ 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