Nonvanishing of minimizers of the approximate Levy-Lieb functional

Let Fα,(0)(r)F^{\boldsymbol{\alpha},(0)}(r) be the approximate Levy–Lieb functional for a discretized density rr, and let ψ\psi be any minimizer. The zero set is measured by Lebesgue measure in configuration space RdN\mathbb{R}^{dN}.

Nonvanishing-minimizer conjecture. Any minimizer ψ\psi of Fα,(0)(r)F^{\boldsymbol{\alpha},(0)}(r) satisfies

{xRdN:ψ(x)=0}=0.\left|\left\{x\in\mathbb{R}^{dN}:\psi(x)=0\right\}\right|=0.

This condition is stated as sufficient for extending the discretized pure excited-state representability theorem from one particle to arbitrary particle number. Its status is not resolved in the paper.

Sources & referencesView supporting material

Primary source

Louis Garrigue, “Building Kohn-Sham potentials for ground and excited states”, arXiv:2101.01127 (2022).

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