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This module from the 2025 PSI course "Electronic-structure simulations for user communities at large-scale facilities" focuses on automated simulations for large-scale-facility applications. Learn from experts Timo Reents, Miki Bonacci, Andres Ortega-Guerrero, Xing Wang, and Giovanni Pizzi from PSI and Empa as they present advanced techniques for automating electronic-structure simulations in large-scale facility environments. The nearly two-hour session, scheduled for April 9th, 2025, constitutes the fourth module of the comprehensive course, providing valuable insights into computational workflows and automation strategies specifically designed for research infrastructure applications. For additional course information and registration details, visit the PSI course page through the provided link.
Syllabus
Module 4: Automated simulations for large-scale-facility applications
Taught by
Materials Cloud