Linear response time-dependent density functional theory of the Hubbard dimer

Density functional theory of electron transfer beyond the Born-Oppenheimer approximation: Case study of LiF

(2018) Chen Li et al.   JOURNAL OF CHEMICAL PHYSICS

Nonadiabatic Dynamics in Single-Electron Tunneling Devices with Time-Dependent Density-Functional Theory

(2018) Niklas Dittmann et al.   PHYSICAL REVIEW LETTERS

Perspective: Fundamental aspects of time-dependent density functional theory

(2016) Neepa T. Maitra   JOURNAL OF CHEMICAL PHYSICS

Organic Electronic Materials: Recent Advances in the DFT Description of the Ground and Excited States Using Tuned Range-Separated Hybrid Functionals

(2014) Thomas Körzdörfer et al.   ACCOUNTS OF CHEMICAL RESEARCH

Challenging adiabatic time-dependent density functional theory with a Hubbard dimer: the case of time-resolved long-range charge transfer

(2014) Johanna I. Fuks et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Time-dependent exchange-correlation functional for a Hubbard dimer: Quantifying nonadiabatic effects

(2014) Johanna I. Fuks et al.   PHYSICAL REVIEW A

Charge transfer in time-dependent density-functional theory: Insights from the asymmetric Hubbard dimer

(2014) J. I. Fuks et al.   PHYSICAL REVIEW A

Adiabatic and local approximations for the Kohn-Sham potential in time-dependent Hubbard chains

(2014) L. Mancini et al.   PHYSICAL REVIEW B

Frequency Dependence of the Exact Exchange-Correlation Kernel of Time-Dependent Density-Functional Theory

(2014) M. Thiele et al.   PHYSICAL REVIEW LETTERS

Exact time-dependent density functional theory for impurity models

(2013) Peter Schmitteckert et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Analytic density functionals with initial-state dependence and memory

(2013) M. Ruggenthaler et al.   PHYSICAL REVIEW A

Density functionals and model Hamiltonians: Pillars of many-particle physics

(2013) Klaus Capelle et al.   PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS

Three-dimensional dynamics of a fermionic Mott wedding-cake in clean and disordered optical lattices

(2013) A. Kartsev et al.   Scientific Reports

Progress in Time-Dependent Density-Functional Theory

(2012) M.E. Casida et al.   Annual Review of Physical Chemistry

The calculations of excited-state properties with Time-Dependent Density Functional Theory

(2012) Carlo Adamo et al.   CHEMICAL SOCIETY REVIEWS

Excitation Gaps of Finite-Sized Systems from Optimally Tuned Range-Separated Hybrid Functionals

(2012) Leeor Kronik et al.   Journal of Chemical Theory and Computation

Exact Kohn-Sham eigenstates versus quasiparticles in simple models of strongly correlated electrons

(2012) D. J. Carrascal et al.   PHYSICAL REVIEW B

Time-dependent density functional theory on a lattice

(2012) M. Farzanehpour et al.   PHYSICAL REVIEW B

Bethe Ansatz Approach to the Kondo Effect within Density-Functional Theory

(2012) Justin P. Bergfield et al.   PHYSICAL REVIEW LETTERS

Perspectives on double-excitations in TDDFT

(2011) Peter Elliott et al.   CHEMICAL PHYSICS

Assessment of dressed time-dependent density-functional theory for the low-lying valence states of 28 organic chromophores

(2011) Miquel Huix-Rotllant et al.   CHEMICAL PHYSICS

Dynamical self-stabilization of the Mott insulator: Time evolution of the density and entanglement entropy of out-of-equilibrium cold fermion gases

(2011) D. Karlsson et al.   EPL

Time-dependent current density functional theory on a lattice

(2011) I. V. Tokatly   PHYSICAL REVIEW B

Towards a Description of the Kondo Effect Using Time-Dependent Density-Functional Theory

(2011) G. Stefanucci et al.   PHYSICAL REVIEW LETTERS

Tuned Range-Separated Hybrids in Density Functional Theory

(2010) Roi Baer et al.   Annual Review of Physical Chemistry

Dressed TDDFT study of low-lying electronic excited states in selected linear polyenes and diphenylopolyenes

(2010) Grzegorz Mazur et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Adiabatic approximation in time-dependent reduced-density-matrix functional theory

(2010) Ryan Requist et al.   PHYSICAL REVIEW A

Dynamical Coulomb Blockade and the Derivative Discontinuity of Time-Dependent Density Functional Theory

(2010) S. Kurth et al.   PHYSICAL REVIEW LETTERS

Extensive TD-DFT Benchmark: Singlet-Excited States of Organic Molecules

(2009) Denis Jacquemin et al.   Journal of Chemical Theory and Computation

Reliable Prediction of Charge Transfer Excitations in Molecular Complexes Using Time-Dependent Density Functional Theory

(2009) Tamar Stein et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Time-dependent V-representability on lattice systems

(2008) Yonghui Li et al.   JOURNAL OF CHEMICAL PHYSICS

On the mapping of time-dependent densities onto potentials in quantum mechanics

(2008) Roi Baer   JOURNAL OF CHEMICAL PHYSICS

Application of the dressed time-dependent density functional theory for the excited states of linear polyenes

(2008) Grzegorz Mazur et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Generalized Kohn-Sham system in one-matrix functional theory

(2008) Ryan Requist et al.   PHYSICAL REVIEW B

Time-Dependent Density-Functional Theory and Strongly Correlated Systems: Insight from Numerical Studies

(2008) Claudio Verdozzi   PHYSICAL REVIEW LETTERS