Date
Participants
Ben Pritchard
Goals
New advancements
New submissions
Upcoming infrastructure improvements
STANDARDSv3 submission machinery in QCSubmit
STANDARDSv3 submission machinery in qca-dataset-submission
Upcoming science support
Enforced c1 symmetry in psi4 is ready
Larger advances
Automated FF coverage gap identification, torsion prioritization, submission generation
Benchmarking (dashboard, etc.)
Discussion topics
Item | Presenter | Notes |
---|---|---|
QCFractal Server updates | ||
Add Comment