{"id":820,"date":"2020-11-23T15:57:59","date_gmt":"2020-11-23T14:57:59","guid":{"rendered":"http:\/\/calculs.univ-cotedazur.fr\/?page_id=820"},"modified":"2025-06-11T16:13:48","modified_gmt":"2025-06-11T14:13:48","slug":"gaussian","status":"publish","type":"page","link":"https:\/\/calculs.univ-cotedazur.fr\/?page_id=820&lang=en","title":{"rendered":"Gaussian"},"content":{"rendered":"\n<p>In order to use Gaussian, you must be a part of the Linux group \u00ab\u00a0icn\u00a0\u00bb. You can check the groups you belong to by calling the <strong>groups<\/strong> command. If you&rsquo;re not a member of icn and you&rsquo;d like to use Gaussian, please <a href=\"https:\/\/calculs.univ-cotedazur.fr\/?page_id=463&amp;lang=en\">contact us<\/a>.<\/p>\n\n\n\n<p><strong>Only works on Intel processors.<\/strong><\/p>\n\n\n\n<p>Here&rsquo;s a job example:<\/p>\n\n\n\n<pre class=\"wp-block-verse\">#!\/bin\/bash\n#SBATCH --job-name=test\n#SBATCH --output=output.txt\n#SBATCH --ntasks=20\n#SBATCH --time=0-02:00:00\n#SBATCH --account=your_account\n#SBATCH --partition=cpucourt\n#SBATCH --constraint=intel\n\n module purge\n module load gaussian\/g16\n source $g16root\/g16\/bsd\/g16.profile\n cd \/workspace\/username\/my_folder\n g16 EF1Snew.com &gt; EF1Snew.log<\/pre>\n","protected":false},"excerpt":{"rendered":"<p>In order to use Gaussian, you must be a part of the Linux group \u00ab\u00a0icn\u00a0\u00bb. You can check the groups you belong to by calling the groups command. If you&rsquo;re not a member of icn and you&rsquo;d like to use &hellip; <\/p>\n","protected":false},"author":1,"featured_media":0,"parent":545,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":[],"_links":{"self":[{"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/pages\/820"}],"collection":[{"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/pages"}],"about":[{"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/types\/page"}],"author":[{"embeddable":true,"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=820"}],"version-history":[{"count":3,"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/pages\/820\/revisions"}],"predecessor-version":[{"id":3060,"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/pages\/820\/revisions\/3060"}],"up":[{"embeddable":true,"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/pages\/545"}],"wp:attachment":[{"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=820"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}