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.

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

Implement NSCF calculations #1

Open
RandomDefaultUser opened this issue Aug 15, 2021 · 0 comments
Open

Implement NSCF calculations #1

RandomDefaultUser opened this issue Aug 15, 2021 · 0 comments

Comments

@RandomDefaultUser
Copy link
Member

To make the whole workflow more efficient, it would be nice to run SCF calculations with DFT accuracy k-grid, then a NSCF calculation on top of which the LDOS is calculated with the LDOS accuracy k-grid.

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Projects
None yet
Development

No branches or pull requests

1 participant