{"id":818,"date":"2020-11-23T15:54:22","date_gmt":"2020-11-23T14:54:22","guid":{"rendered":"http:\/\/calculs.univ-cotedazur.fr\/?page_id=818"},"modified":"2025-06-11T16:13:33","modified_gmt":"2025-06-11T14:13:33","slug":"gaussian","status":"publish","type":"page","link":"https:\/\/calculs.univ-cotedazur.fr\/?page_id=818","title":{"rendered":"Gaussian"},"content":{"rendered":"\n<p>Pour utiliser Gaussian, vous devez faire partie du groupe Linux \u00ab\u00a0icn\u00a0\u00bb. Vous pouvez le v\u00e9rifier en tapant la commande <strong>groups<\/strong> et si ce n&rsquo;est pas le cas, <a href=\"https:\/\/calculs.univ-cotedazur.fr\/?page_id=17\">envoyez-nous une demande<\/a>.<\/p>\n\n\n\n<p><strong>Fonctionne uniquement sur les machines \u00e9quip\u00e9es de processeurs Intel.<\/strong><\/p>\n\n\n\n<p>Exemple de job :<\/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>Pour utiliser Gaussian, vous devez faire partie du groupe Linux \u00ab\u00a0icn\u00a0\u00bb. Vous pouvez le v\u00e9rifier en tapant la commande groups et si ce n&rsquo;est pas le cas, envoyez-nous une demande. Fonctionne uniquement sur les machines \u00e9quip\u00e9es de processeurs Intel. Exemple &hellip; <\/p>\n","protected":false},"author":1,"featured_media":0,"parent":207,"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\/818"}],"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=818"}],"version-history":[{"count":3,"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/pages\/818\/revisions"}],"predecessor-version":[{"id":3059,"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/pages\/818\/revisions\/3059"}],"up":[{"embeddable":true,"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=\/wp\/v2\/pages\/207"}],"wp:attachment":[{"href":"https:\/\/calculs.univ-cotedazur.fr\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=818"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}