Time-Dependent Density Functional Theory with Coulomb Interactions
Abstract
We provide the first fully rigorous justification of time-dependent density functional theory in the continuum: Given a time-dependent density, we prove that there exists an external potential, unique up to a time-dependent constant, such that the corresponding Schrödinger equation reproduces the given density. This potential can be obtained with an iteration scheme. Our argument covers Coulomb interactions and does not need any Taylor expansion in time. It instead requires analyticity in space ...
Description / Details
We provide the first fully rigorous justification of time-dependent density functional theory in the continuum: Given a time-dependent density, we prove that there exists an external potential, unique up to a time-dependent constant, such that the corresponding Schrödinger equation reproduces the given density. This potential can be obtained with an iteration scheme. Our argument covers Coulomb interactions and does not need any Taylor expansion in time. It instead requires analyticity in space for the density and potential, which is compatible with extended nuclei.
Source: arXiv:2609.08983v1 - http://arxiv.org/abs/2609.08983v1 PDF: https://arxiv.org/pdf/2609.08983v1 Original Link: http://arxiv.org/abs/2609.08983v1
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Sep 9, 2026
Chemistry
Chemistry
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