相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Linear response time-dependent density functional theory of the Hubbard dimer
Diego J. Carrascal et al.
EUROPEAN PHYSICAL JOURNAL B (2018)
Exploring weight-dependent density-functional approximations for ensembles in the Hubbard dimer
Killian Deur et al.
EUROPEAN PHYSICAL JOURNAL B (2018)
Charge transfer excitations from exact and approximate ensemble Kohn-Sham theory
Tim Gould et al.
JOURNAL OF CHEMICAL PHYSICS (2018)
Unified formulation of fundamental and optical gap problems in density-functional theory for ensembles
Bruno Senjean et al.
PHYSICAL REVIEW A (2018)
Density-functional theory for systems with noncollinear spin: Orbital-dependent exchange-correlation functionals and their application to the Hubbard dimer
Carsten A. Ullrich
PHYSICAL REVIEW B (2018)
Direct Extraction of Excitation Energies from Ensemble Density-Functional Theory
Zeng-hui Yang et al.
PHYSICAL REVIEW LETTERS (2017)
Hartree and Exchange in Ensemble Density Functional Theory: Avoiding the Nonuniqueness Disaster
Tim Gould et al.
PHYSICAL REVIEW LETTERS (2017)
Exact ensemble density functional theory for excited states in a model system: Investigating the weight dependence of the correlation energy
Killian Deur et al.
PHYSICAL REVIEW B (2017)
Perspective: Fundamental aspects of time-dependent density functional theory
Neepa T. Maitra
JOURNAL OF CHEMICAL PHYSICS (2016)
Ghost-interaction correction in ensemble density-functional theory for excited states with and without range separation
Md. Mehboob Alam et al.
PHYSICAL REVIEW A (2016)
The Hubbard dimer: a density functional case study of a many-body problem
D. J. Carrascal et al.
JOURNAL OF PHYSICS-CONDENSED MATTER (2015)
Excitations and benchmark ensemble density functional theory for two electrons
Aurora Pribram-Jones et al.
JOURNAL OF CHEMICAL PHYSICS (2014)
Generalised adiabatic connection in ensemble density-functional theory for excited states: example of the H-2 molecule
Odile Franck et al.
MOLECULAR PHYSICS (2014)
Exact and approximate Kohn-Sham potentials in ensemble density-functional theory
Zeng-hui Yang et al.
PHYSICAL REVIEW A (2014)
Density functionals and model Hamiltonians: Pillars of many-particle physics
Klaus Capelle et al.
PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS (2013)
Assessment of dressed time-dependent density-functional theory for the low-lying valence states of 28 organic chromophores
Miquel Huix-Rotllant et al.
CHEMICAL PHYSICS (2011)
Time-dependent density functional theory: Past, present, and future
K Burke et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
A dressed TDDFT treatment of the 2Ag states of butadiene and hexatriene
RJ Cave et al.
CHEMICAL PHYSICS LETTERS (2004)
Double excitations within time-dependent density functional theory linear response
NT Maitra et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Adiabatic connection for near degenerate excited states
F Zhang et al.
PHYSICAL REVIEW A (2004)
Ghost- and self-interaction-free ensemble calculations with local exchange-correlation potential for atoms
F Tasnádi et al.
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS (2003)
Resonant nonlinear polarizabilities in the time-dependent density functional theory
S Tretiak et al.
JOURNAL OF CHEMICAL PHYSICS (2003)