Une approximation pour des paramètres semi-empiriques dans le calcul LCAO des molécules organiques conjuguées - I. — Application à la pyridine et au pyridinium
J. Chim. Phys., 61 (1964) 697-705
Published online: 2017-05-28
Articles citing this article
The Citing articles tool gives a list of articles citing the current article.
The citing articles come from EDP Sciences database, as well as other publishers participating in CrossRef Cited-by Linking Program. You can set up your personal account to receive an email alert each time this article is cited by a new article (see the menu on the right-hand side of the abstract page).
Cited article:
This article has been cited by the following article(s):
Molecular Simulation in Latin America: Coming of Age
Thereza A. Soares and Habibah A. WahabJournal of Chemical Information and Modeling 59 (9) 3601 (2019)
https://doi.org/10.1021/acs.jcim.9b00589
About counterintuitive orbital mixing and bond populations
Francisco Elias Jorge, Mario Giambiagi and Myriam S. GiambiagiTheoretica Chimica Acta 63 (6) 529 (1983)
https://doi.org/10.1007/BF02394811
About counterintuitive orbital mixing and bond populations
Francisco Elias Jorge, Mario Giambiagi and Myriam S. de GiambiagiTheoretica chimica acta 63 (6) 529 (1983)
https://doi.org/10.1007/PL00020126
Calculation of bond energies in diatomic molecules
G. HooydonkTheoretica Chimica Acta 22 (2) 157 (1971)
https://doi.org/10.1007/BF00537624
Comparative borazarobenzenes calculations following different methods
R. Carb�, M. S. Giambiagi and Mario GiambiagiTheoretica Chimica Acta 14 (2) 147 (1969)
https://doi.org/10.1007/BF00528231
On the development of semiempirical methods in the MO formalism
Karl JugTheoretica Chimica Acta 14 (2) 91 (1969)
https://doi.org/10.1007/BF00528229
Sequence of energy levels in molecular calculations with a nonorthogonal basis
R. Carbó, M. S. de Giambiagi and M. GiambiagiIl Nuovo Cimento B Series 10 59 (2) 204 (1969)
https://doi.org/10.1007/BF02711032
PPP-Berechnungen und Vergleich der Elektronenspektren von iso-?-elektronischen Sauerstoff-, Stickstoff-, Schwefel- und Selenheterocyclen
J. Fabian, A. Mehlhorn and R. Zahradn�kTheoretica Chimica Acta 12 (3) 247 (1968)
https://doi.org/10.1007/BF00528272
13 55 (1967)
https://doi.org/10.1002/9780470140154.ch4
An analysis of the polarizabilities in some conjugated molecules
Myriam Segre Giambiagi and Mario GiambiagiTheoretica Chimica Acta 8 (4) 341 (1967)
https://doi.org/10.1007/BF00528179
? Electronic distribution, charge transfer and intensities of infrared absorption bands in borazine
Mario Giambiagi, Myriam Segre Giambiagi and Enrique SilbermanTheoretica Chimica Acta 5 (5) 435 (1966)
https://doi.org/10.1007/BF00527046
Quelques considérations sur la structure électronique du naphtalène
Héctor C. González, Myriam Segre Giambiagi and Mario GiambiagiTheoretica Chimica Acta 6 (3) 257 (1966)
https://doi.org/10.1007/BF02394702
Semi-empirical approximations for the coulomb and bond integrals in simple LCAO-MO methods
Ricardo FerreiraTheoretica Chimica Acta 3 (2) 147 (1965)
https://doi.org/10.1007/BF00527345
Perturbation expansion for bond orders and the commutator [H, S]
S. W. MacDowell, M. Giambiagi and M. S. GiambiagiIl Nuovo Cimento 35 (2) 410 (1965)
https://doi.org/10.1007/BF02735327
Extended Hückel theory applied to nucleophilic substitution in pyridine, quinoline and isoquinoline
W. Adam and A. GrimisonTetrahedron 21 (12) 3417 (1965)
https://doi.org/10.1016/S0040-4020(01)96963-7