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TODO.md

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Wishlist for the usage of 1-D code

o Basic SCF.

o Preconditioning strategies

o Ze. Atomic force evaluation and relaxation. (Done.) Density functional perturbation theory, and notebook

o Jiefu. Projection based embedding theory (require model XC)

o Dong. TDDFT, and Notebook

o Michael. Notebook: One dimensional H_2^+ molecule. Compare with minimal basis set approximation

o Yu. Notebook: 1-d crystal. Band structure plot. Brillouin zone sampling.

o Done. Notebook: demonstrate how SCF works. Insulator and metal.

o Jeffmin: Notebook: Hartree-Fock ansatz for He atom / H2

o Weile: Notebook: time-dependent DFT. Casida formalism. Compare with time-dependent simulation.

o Notebook: Localization. SCDM and Wannier.