Skip to content
New issue

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

#

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

Already on GitHub? # to your account

Jump to bottom

Add full potential calculation #1

Open
aromanro opened this issue Jan 16, 2020 · 0 comments
Open

Add full potential calculation #1

aromanro opened this issue Jan 16, 2020 · 0 comments
Assignees
@aromanro
Labels
enhancement New feature or request

Comments

@aromanro
Copy link
Owner

aromanro commented Jan 16, 2020 •
edited
Loading

With LAPW and DFT, a full potential method can be implemented. The code for DFT can be reused from the DFTAtom project https://github.com/aromanro/DFTAtom.

It won't happen soon, though, I need more motivation and free time for such a thing. Besides, there is a little too much on bandstructure computation compared with other projects, so for a while I'll take care of other subjects.
@aromanro aromanro added the enhancement New feature or request label Jan 16, 2020
@aromanro aromanro self-assigned this Jan 16, 2020
# for free to join this conversation on GitHub. Already have an account? # to comment
Assignees

@aromanro aromanro

Labels
enhancement New feature or request
Projects
None yet
Milestone
No milestone
Development

No branches or pull requests
1 participant
@aromanro