(Q46612058)

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31 December 2019

title

Study of 7-azaindole in its first four singlet states (English)

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31 December 2019

1

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31 December 2019

author name string

de Paz JL

series ordinal

2

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31 December 2019

language of work or name

English

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publication date

1 June 2005

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Journal of Chemical Physics

31 December 2019

published in

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31 December 2019

volume

122

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31 December 2019

issue

24

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31 December 2019

page(s)

244320

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Spectrothermodynamic relationship of cationic vs anionic species derived from protonation vs deprotonation of pyrrolo-aza-aromatic bases in homologous series.

31 December 2019

cites work

1 reference

Excited-state two-proton tautomerism in hydrogen-bonded n-heterocyclic base pairs

21 January 2018

1 reference

Electronic structure calculations on workstation computers: The program system turbomole

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

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

21 January 2018

1 reference

Photoinduced intramolecular charge transfer in 4-(dimethyl)aminobenzonitrile--a theoretical perspective

21 January 2018

1 reference

Analytical time-dependent density functional derivative methods within the RI-J approximation, an approach to excited states of large molecules

21 January 2018

1 reference

Generalized Gradient Approximation Made Simple

21 January 2018

1 reference

Evaluated Gas Phase Basicities and Proton Affinities of Molecules; Heats of Formation of Protonated Molecules

21 January 2018

1 reference

Comment on “Assessment of exchange correlation functionals” [A.J. Cohen, N.C. Handy, Chem. Phys. Lett. 316 (2000) 160–166]

21 January 2018

1 reference

On the density matrix based approach to time-dependent density functional response theory

21 January 2018

1 reference

Adiabatic time-dependent density functional methods for excited state properties

21 January 2018

1 reference

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

21 January 2018

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21 January 2018

Identifiers

DOI

10.1063/1.1940607

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31 December 2019

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