14 citations · 14 across the 1 of their papers we have counts for
2 papers
physics.chem-ph2020★ 14 cited
Learning on-top: regressing the on-top pair density for real-space visualization of electron correlation
Alberto Fabrizio, Ksenia R. Briling, David D. Girardier +1
The on-top pair density [] is a local quantum-chemical property that reflects the probability of two electrons of any spin to occupy the same position in sp…
physics.chem-ph2020
Learning the energy curvature versus particle number in approximate density functionals
Alberto Fabrizio, Benjamin Meyer, Clemence Corminboeuf
The average energy curvature as a function of the particle number is a molecule-specific quantity, which measures the deviation of a given functional from the exact conditions of d…