Notes - Svatunek // Lab
A collection of short technical notes, whitepapers, tutorials, and informal write-ups documenting methods, tools, workflows, and observations that arise in our day-to-day research and teaching, by members of Svatunek // lab.
Latest
Section titled “Latest”- Running UMA with ORCA on the NVIDIA DGX Spark
Notes on setting up orca-mlips with the UMA foundation model on the NVIDIA DGX Spark, including ARM-specific considerations and a persistent Docker-based workflow for efficient ORCA external calculations.
- (Comp)Chem on Windows on ARM
Notes on using Windows on ARM for (Computational) Chemistry. What works and what doesn't.