hf_again/TODO.txt
2024-11-05 22:23:16 +01:00

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//~ TODO
//-
/**
*
[-] Use arena for matrices instead of malloc maybe
[-] Factor l-dependent matrix
[-] Print eigenfunctions for plotting
[-] Solve for more shells
[-] Make some good orbital/atom abstraction
[-] Then try to make hartree fock work maybe.
[-] Need to make a Complex double (Z64) version if I want to go relativistic
[-] Smarter way to multiply bsplines and do gauss integration?
*
*/