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Webinar "Running Gaussian16 and NBO7 effectively on Nibi and Fir: Performance Issues"
Remarque : Toutes les heures sont affichées selon le fuseau horaire dans lequel l’événement a lieu.
Date: 11 février 2026, 13:00 - 14:00
Fuseau horaire: heure d’été de l’Est nord-américain
Langue d'enseignement: Anglais
Topic: "Running Gaussian16 and NBO7 effectively on Nibi and Fir: Performance Issues"
Speaker: Jemmy Hu, SHARCNET
Registration link
Recording
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In this talk, we will review approaches for running Gaussian and NBO7 jobs on the new Alliance clusters, Fir and Nibi. To better understand performance on these systems, we conducted benchmark tests using several commonly used Gaussian methods—B3LYP, MP2, CISD, and CCSD(T)—across a range of CPU counts for molecules of reasonable size. The results provide practical guidance on selecting appropriate CPU allocations to run Gaussian jobs more efficiently on Alliance clusters. All current and prospective Gaussian users are strongly encouraged to attend.
Zoom account is required. Webinar registration is required. VERY IMPORTANT: During registration, you have to provide the email address which is associated with your Zoom account, otherwise you won't be able to register and/or attend the webinar! Need help attending a webinar? See the SHARCNET Help Wiki.
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