302 citations · 1.9k across the 50 of their papers we have counts for
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physics.comp-ph2015★ 31 cited
Fermi orbital self-interaction corrected electronic structure of molecules beyond local density approximation
Torsten Hahn, Simon Liebing, Jens Kortus +1
The correction of the self-interaction error (SIE) that is inherent to all standard density functional theory (DFT) calculations is an object of increasing interest. In this articl…
physics.chem-ph2015★ 1 cited
Practical and Rigorous reduction of the Many-Electron Quantum-Mechanical Coulomb Problem to O(N^(2/3) Storage
Mark R. Pederson
It is tacitly accepted that, for practical basis sets consisting of N functions, solution of the two-electron Coulomb problem in quantum mechanics requires storage of O(N^4) integr…