(Q51837883)

English

On the relation between time-dependent and variational density functional theory approaches for the determination of excitation energies and transition moments.

scientific article published in April 2009

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scholarly article

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

On the relation between time-dependent and variational density functional theory approaches for the determination of excitation energies and transition moments. (English)

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

density functional theory

1 reference

based on heuristic

inferred from title

Jochen Autschbach

4

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

author name string

Tom Ziegler

1

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

Michael Seth

2

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

Mykhaylo Krykunov

3

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

Fan Wang

5

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

language of work or name

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publication date

1 April 2009

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

Journal of Chemical Physics

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

130

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

15

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

154102

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

Self-Consistent Equations Including Exchange and Correlation Effects

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Density-functional approximation for the correlation energy of the inhomogeneous electron gas

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Exchange holes in inhomogeneous systems: A coordinate-space model

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Density-functional thermochemistry. III. The role of exact exchange

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Prescription for the design and selection of density functional approximations: more constraint satisfaction with fewer fits

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Spurious interactions, and their correction, in the ensemble-Kohn-Sham scheme for excited States.

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Self-consistent field calculations of excited states using the maximum overlap method (MOM).

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Density-Functional Theory for Time-Dependent Systems

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Excitation Energies from Time-Dependent Density-Functional Theory

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Linear-scaling implementation of molecular electronic self-consistent field theory.

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Exchange-correlation density functional beyond the gradient approximation

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other fun

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Density Functionals with Broad Applicability in Chemistry

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Density-functional theory for ensembles of fractionally occupied states. II. Application to the He atom

1 reference

https://api.crossref.org/works/10.1063%2F1.3114988

21 January 2018

Identifiers

10.1063/1.3114988

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

13 April 2018

http://europepmc.org/abstract/MED/19388731

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