70 citations · 109 across the 7 of their papers we have counts for
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physics.chem-ph2022★ 5 cited
Nuclear cusps and singularities in the non-additive kinetic potential bi-functional from analytical inversion
Mojdeh Banafsheh, Tomasz A. Wesolowski, Tim Gould +2
The non-additive kinetic potential is a key quantity in density-functional theory (DFT) embedding methods, such as frozen density embedding theory and partition DF…
physics.chem-ph2014★ 70 cited
Kohn-Sham potentials in exact density-functional theory at non-integer electron numbers
Tim Gould, Julien Toulouse
Within exact electron density-functional theory, we investigate Kohn-Sham (KS) potentials, orbital energies, and non-interacting kinetic energies of the fractional ions of Li, C an…