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20182026
most citedThird order Møller-Plesset theory made more useful? The role of density functional theory orbitals

42 citations · 161 across the 11 of their papers we have counts for

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physics.chem-ph2022★ 3 cited

Faster Exact Exchange for Solids via occ-RI-K: Application to Combinatorially Optimized Range-Separated Hybrid Functionals for Simple Solids with Pseudopotentials Near the Basis Set Limit

Joonho Lee, Adam Rettig, Xintian Feng +2

In this work, we developed and showcased the occ-RI-K algorithm to compute the exact exchange contribution in density functional calculations of solids near the basis set limit. Wi…