85 citations · 119 across the 5 of their papers we have counts for
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physics.chem-ph2020★ 9 cited
Using Electronegativity and Hardness to Test Density Functional Universality
Klaus A. Moltved, Kasper P. Kepp
Density functional theory (DFT) is used in thousands of papers each year, yet lack of universality reduces DFT's predictive capacity, and functionals may produce energy-density imb…
physics.chem-ph2017★ 1 cited
Energy vs. density on paths toward more exact density functionals
Kasper Planeta Kepp
Recently, the progression toward more exact density functional theory has been questioned, implying a need for more formal ways to systematically measure progress, i.e. a path. Her…
physics.chem-ph2017★ 85 cited
Density Functional Theory is Not Straying from the Path toward the Exact Functional
Kasper Planeta Kepp
Recently (Science, 355, 6320, 2017, 49-52) it was argued that density functionals stray from the path towards exactness due to errors in densities (ρ) of 14 atoms and ions computed…