(Q51905955)

17 April 2018

title

Time-dependent density functional theory based upon the fragment molecular orbital method. (English)

1 reference

17 April 2018

density functional theory

main subject

1 reference

based on heuristic

inferred from title

time-dependent density functional theory

1 reference

Mahito Chiba

1

1 reference

17 April 2018

Dmitri G Fedorov

series ordinal

2

1 reference

17 April 2018

Kazuo Kitaura

series ordinal

3

1 reference

17 April 2018

language of work or name

English

0 references

publication date

1 September 2007

1 reference

17 April 2018

Journal of Chemical Physics

published in

1 reference

17 April 2018

volume

127

1 reference

17 April 2018

issue

10

1 reference

17 April 2018

page(s)

104108

1 reference

17 April 2018

Density-Functional Theory for Time-Dependent Systems

cites work

1 reference

Cluster expansion of the wavefunction. Symmetry‐adapted‐cluster expansion, its variational determination, and extension of open‐shell orbital theory

21 January 2018

1 reference

A long-range-corrected time-dependent density functional theory.

21 January 2018

1 reference

Excited state geometry optimizations by analytical energy gradient of long-range corrected time-dependent density functional theory.

21 January 2018

1 reference

Long-range corrected time-dependent density functional study on fluorescence of 4,4'-dimethylaminobenzonitrile.

21 January 2018

1 reference

Extending the power of quantum chemistry to large systems with the fragment molecular orbital method

21 January 2018

1 reference

Second order Møller-Plesset perturbation theory based upon the fragment molecular orbital method

21 January 2018

1 reference

Coupled-cluster theory based upon the fragment molecular-orbital method

21 January 2018

1 reference

Symmetry-adapted-cluster/symmetry-adapted-cluster configuration interaction methodology extended to giant molecular systems: ring molecular crystals.

21 January 2018

1 reference

Density-functional exchange-energy approximation with correct asymptotic behavior

21 January 2018

1 reference

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

21 January 2018

1 reference

General atomic and molecular electronic structure system

21 January 2018

1 reference

Photoreaction cycle of photoactive yellow protein from Ectothiorhodospira halophila studied by low-temperature spectroscopy.

21 January 2018

1 reference

Erratum: “Time-dependent density functional methods for excited state properties” [J. Chem. Phys. 117, 7433 (2002)]

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.2772850

1 reference

17 April 2018

1 reference

17 April 2018