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fhi-aims hamiltonian

Open zerothi opened this issue 4 months ago • 4 comments

Describe the feature

It would be great to allow reading in fhi-aims hamiltonians. In this way we could have an all-electron Hamiltonian access point.

@ialcon here your help could be really valuable, trying to get this up and running requires knowledge on the aims side (which I don't have), and also there is plenty of code in sisl to see how to read stuff from.

zerothi avatar Feb 29 '24 08:02 zerothi