Skip to content
New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

Sign up for GitHub

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

Jump to bottom

No multi-thread instructions in user guide #157

Open
jeanwsr opened this issue Mar 20, 2025 · 1 comment
Open

No multi-thread instructions in user guide #157

jeanwsr opened this issue Mar 20, 2025 · 1 comment

Comments

@jeanwsr
Copy link
Contributor

jeanwsr commented Mar 20, 2025 •
edited
Loading

Surprisingly I found there's almost no documentation for the usage of lib.num_threads() or environment variables in the quick start or user guide (I've searched "thread" and "openmp"). Although this is common knowledge for experienced pyscf users, I believe there should be a few words for multi-thread instructions for starters.
@tberkel
Copy link
Contributor

tberkel commented Mar 20, 2025

I agree, I'll draft something in the next few days and PR for feedback.

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Assignees
No one assigned
Labels
None yet
Projects
None yet
Milestone
No milestone
Development

No branches or pull requests
2 participants
@tberkel @jeanwsr