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Publication details

Document type
Journal articles

Document subtype
Full paper

Title
A cost-effective basis-set extrapolation scheme: Application to the energetics of homolytic bond dissociation

Participants in the publication
Filipe Agapito (Author)
Benedito J. Costa Cabral (Author)
José A. Martinho Simões (Author)
Dep. Química e Bioquímica
 CQB
Date of Publication
2007

Where published
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

Publication Identifiers
ISSN - 0166-1280

Publisher
Elsevier BV

Volume
811
Number
1-3

Starting page
361
Last page
372

Document Identifiers
DOI - https://doi.org/10.1016/j.theochem.2006.12.050


Export

APA
Filipe Agapito, Benedito J. Costa Cabral, José A. Martinho Simões, (2007). A cost-effective basis-set extrapolation scheme: Application to the energetics of homolytic bond dissociation. JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 811, 361-372. ISSN 0166-1280. eISSN .

IEEE
Filipe Agapito, Benedito J. Costa Cabral, José A. Martinho Simões, "A cost-effective basis-set extrapolation scheme: Application to the energetics of homolytic bond dissociation" in JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, vol. 811, pp. 361-372, 2007. 10.1016/j.theochem.2006.12.050

BIBTEX
@article{27827, author = {Filipe Agapito and Benedito J. Costa Cabral and José A. Martinho Simões}, title = {A cost-effective basis-set extrapolation scheme: Application to the energetics of homolytic bond dissociation}, journal = {JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM}, year = 2007, pages = {361-372}, volume = 811 }