Literature DB >> 19764792

Comment on "Excited states of DNA base pairs using long-range corrected time-dependent density functional theory".

Michael D Sevilla1.   

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Year:  2009        PMID: 19764792      PMCID: PMC4679139          DOI: 10.1021/jp908098a

Source DB:  PubMed          Journal:  J Phys Chem A        ISSN: 1089-5639            Impact factor:   2.781


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  7 in total

1.  Single-reference ab initio methods for the calculation of excited states of large molecules.

Authors:  Andreas Dreuw; Martin Head-Gordon
Journal:  Chem Rev       Date:  2005-11       Impact factor: 60.622

2.  Electron-transfer oxidation properties of DNA bases and DNA oligomers.

Authors:  Shunichi Fukuzumi; Hiroshi Miyao; Kei Ohkubo; Tomoyoshi Suenobu
Journal:  J Phys Chem A       Date:  2005-04-21       Impact factor: 2.781

3.  Computation of large systems with an economic basis set: structures and reactivity indices of nucleic acid base pairs from density functional theory.

Authors:  W J Fan; R Q Zhang; Shubin Liu
Journal:  J Comput Chem       Date:  2007-04-15       Impact factor: 3.376

4.  Ab initio determination of the ionization potentials of DNA and RNA nucleobases.

Authors:  Daniel Roca-Sanjuán; Mercedes Rubio; Manuela Merchán; Luis Serrano-Andrés
Journal:  J Chem Phys       Date:  2006-08-28       Impact factor: 3.488

5.  Ab initio study of the ionization of the DNA bases: ionization potentials and excited states of the cations.

Authors:  Emilie Cauët; Dominique Dehareng; Jacques Liévin
Journal:  J Phys Chem A       Date:  2006-07-27       Impact factor: 2.781

6.  Excited states of DNA base pairs using long-range corrected time-dependent density functional theory.

Authors:  Lasse Jensen; Niranjan Govind
Journal:  J Phys Chem A       Date:  2009-09-10       Impact factor: 2.781

7.  Failure of time-dependent density functional theory for long-range charge-transfer excited states: the zincbacteriochlorin-bacteriochlorin and bacteriochlorophyll-spheroidene complexes.

Authors:  Andreas Dreuw; Martin Head-Gordon
Journal:  J Am Chem Soc       Date:  2004-03-31       Impact factor: 15.419

  7 in total

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