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

How to calculate electronic relaxation time #62

Open
kcbhamu opened this issue Sep 4, 2021 · 0 comments
Open

How to calculate electronic relaxation time #62

kcbhamu opened this issue Sep 4, 2021 · 0 comments

Comments

@kcbhamu
Copy link

kcbhamu commented Sep 4, 2021

Dear Developers,
Thanks for a great code.
I do not find a tutorial to calculate the tau.
Could you please tell me how can I calculate the electronic relaxation time for any compound on my cluster?
If I understand correctly the given structure, I need to run scf, nscf, and projection on my cluster then using those files, I can do post-processing on my desktop. Am I right?
I will be very much grateful to you if you can provide me step by step tutorial for the same.

Thanks.

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

No branches or pull requests

1 participant