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physics.chem-ph2017
Reply to "Comment on 'Generalization of the Kohn-Sham system that can represent arbitrary one-electron density matrices'"
Hubertus J. J. van Dam
Our paper [Phys. Rev. A 93, 052512 (2016)], proposing a novel form of single determinant wave function that admits non-idempotent 1-electron density matrices, has recently received…
physics.chem-ph2015★ 1 cited
Generalization of the Kohn-Sham system that can represent arbitary one electron density matrices
Hubertus J J van Dam
Density functional theory is currently the most widely applied method in electronic structure theory. The Kohn-Sham method, based on a fictitious system of non-interacting particle…