Workshop Agenda

Day 1 Molecular Foundry - Summer School Only

Time Activity
9:00 Welcome
9:15 Machine Learning & AI Overview
9:45 Introduction to Halide Perovskites (Speaker: Carolin Sutter-Fella)
10:30 Introduction of Teams
10:45 Break
11:15 Lab Work: Substrate & Precursor Preparation
1:00 Lunch Break
2:00 Lab Work: Robot-driven Halide Perovskite Thin Film Synthesis
3:30 Break
3:45 Lab Work: Robot-driven Halide Perovskite Thin Film Characterization
5:30 Wrap Up Day 1
6:00 Dinner

Day 2 Molecular Foundry - Open to All User Meeting Attendees (Tutorial)

AM: Getting Data Machine Learning Ready

Time Activity
9:00 Intro Using Google Colab, Hands-on (Ed, Morgan)
- Bring your own data
- Create/convert existing code into Colab notebooks
- Connect to data sources
- Prepare your data for ML and score generation
10:00 Data Pre-processing I: Featurization and Visualization Tutorial (Shuan)
10:30 Break
11:00 Data Pre-processing II: Hands-on Heterogeneity Score Generation (PL spectra, UV Vis, PL image) (Shuan, Thong)
12:00 Lunch Break

PM: Application of Machine Learning

Time Activity
1:00 Surrogate Models (Maher Alghalayini)
2:00 Building a Gaussian Process Model with Your Data (Speaker: Maher Alghalayini or Marcus Noack)
2:30 Break
3:00 Bayesian Optimization (Clara Tamura)
4:00 Building an Active Learning Algorithm with Your Data

Day 3 Open to All User Meeting Attendees (Symposium)

AM: Plenary Talks

PM: AI/ML Enabled Materials Development

Time Activity
1:00 Introduction to Closed Loop Experiments (Speaker: Shijing Sun; invited)
1:30 Industry Talk TRI; invited
2:00 Academic Speaker; invited
2:30 Break
3:00 Contributed: Ansuman - AutoBot
3:15 Contributed: Sasha - ALD Bot
3:30 Academic Speaker; invited
4:00 End of the Workshop