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

Different Methods store resulting vxc in different ways. #14

Open

VHchavez opened this issue Feb 7, 2021 · 0 comments

Member

VHchavez commented Feb 7, 2021

WY stores as v_opt
mRKS stores as 'grid.vxc'
ZMP stores as 'pro density', which is not even a potential.

Can we generalize how the result is stored? Do we want the result in AObasis + a simple/small grid for plotting?

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment