Existence, uniqueness, and construction of the density-potential map** in time-dependent density-functional theory

M Ruggenthaler, M Penz… - Journal of Physics …, 2015 - iopscience.iop.org
In this work we review the map** from densities to potentials in quantum mechanics,
which is the basic building block of time-dependent density-functional theory and the Kohn …

Global fixed-point proof of time-dependent density-functional theory

M Ruggenthaler, R van Leeuwen - Europhysics Letters, 2011 - iopscience.iop.org
We reformulate the uniqueness and existence proofs of time-dependent density-functional
theory. The central idea is to restate the fundamental one-to-one correspondence between …

A reformulation of time-dependent Kohn–Sham theory in terms of the second time derivative of the density

W Tarantino, CA Ullrich - The Journal of Chemical Physics, 2021 - pubs.aip.org
The Kohn–Sham approach to time-dependent density-functional theory (TDDFT) can be
formulated, in principle, exactly by invoking the force-balance equation for the density, which …

Time-dependent density functional theory on a lattice

M Farzanehpour, IV Tokatly - Physical Review B—Condensed Matter and …, 2012 - APS
Time-dependent density functional theory (TDDFT) for quantum many-body systems on a
lattice is formulated rigorously. We prove the uniqueness of the density-to-potential map** …

Time-dependent current density functional theory on a lattice

IV Tokatly - Physical Review B—Condensed Matter and Materials …, 2011 - APS
A rigorous formulation of time-dependent current density functional theory (TDCDFT) on a
lattice is presented. The density-to-potential map** and the V-representability problems …

Density-potential map** in time-dependent density-functional theory

NT Maitra, TN Todorov, C Woodward, K Burke - Physical Review A—Atomic …, 2010 - APS
The key questions of uniqueness and existence in time-dependent density-functional theory
are usually formulated only for potentials and densities that are analytic in time. Simple …

Density-potential map**s in quantum dynamics

M Ruggenthaler, KJH Giesbertz, M Penz… - Physical Review A …, 2012 - APS
In a recent paper [Europhys. Lett. 95, 13001 (2011) EULEEJ 0295-5075 10.1209/0295-
5075/95/13001] the question of whether the density of a time-dependent quantum system …

Coulomb potentials and Taylor expansions in time-dependent density-functional theory

S Fournais, J Lampart, M Lewin, TØ Sørensen - Physical Review A, 2016 - APS
We investigate when Taylor expansions can be used to prove the Runge-Gross theorem,
which is at the foundation of time-dependent density-functional theory (TDDFT). We start …

Local Hartree-exchange and correlation potential defined by local force equations

M Ruggenthaler, D Bauer - Physical Review A—Atomic, Molecular, and Optical …, 2009 - APS
From the local force equation of quantum mechanics and by expanding the interacting wave
function in terms of the noninteracting Kohn-Sham wave function, we derive differential …

Effect of cusps in time-dependent quantum mechanics

Z Yang, NT Maitra, K Burke - Physical review letters, 2012 - APS
Within nonrelativistic quantum mechanics, spatial cusps in initial wave functions can lead to
nonanalytic behavior in time. We suggest a method for calculating the short-time behavior in …