HPC Training Series - Course 8 "Computational chemistry and High Performance Computing (HPC)"

Europe/Athens
Description

EuroCC@Greece and the IT Dept. of the Aristotle University of Thessaloniki announces the 8th Course of its HPC Training Series with the subject "Computational chemistry and High Performance Computing (HPC)", taking place online on December 9th, 2024.  

Date: December 9th, 2024, at 10:00 EET 

Location: Online via Zoom

Presentation Language: Greek

Audience Suitable for members of the academic community and industry (researchers, data scientists, ML engineers, etc.) who are interested in the utilisation of High Performance Computing technologies for Computational chemistry applications.

Description: This course provides XX

Prerequisites: XX

Note: Please enter your institutional/corporate email when registering.

    • 10:00 10:15
      Introduction: EuroCC@Greece 15m
      Speaker: Pavlos Sermpezis (AUTH)
    • 10:15 10:45
      Introduction to AUTH’s HPC infrastructure “Aristotelis” 30m
      Speaker: Paschalis Korosoglou (AUTH)
    • 10:45 11:45
      Charge Transfer Unveiled: An Exciting Journey Through TD-DFT 1h
      Speaker: Emmanuel Koukaras (AUTH)
    • 11:45 12:15
      Machine Learning in chemistry for everyone: A practical guide for quick development of predictive models 30m
      Speaker: Georgios Fanourgakis (AUTH)
    • 12:15 12:30
      Questions / Open discussion 15m