Zobrazeno 1 - 10
of 13
pro vyhledávání: '"MILJENKO PERIC"'
Publikováno v:
Journal of the Serbian Chemical Society, Vol 72, Iss 12, Pp 1329-1341 (2007)
In this communication it is shown that the widely held opinion that compact program packages for quantum–mechanical calculations of molecular structure can safely be used as black boxes is completely wrong. In order to illustrate this, the results
Externí odkaz:
https://doaj.org/article/103a64cbaf1f4b62972f16961e3fb1d0
Publikováno v:
Journal of the Serbian Chemical Society, Vol 71, Iss 7, Pp 771-783 (2006)
In spite of being based on drastic simplifications, the Hückel molecular orbital (HMO) quantum-mechanical model provides a reasonably good description of the properties of p-electrons in conjugated molecules. The HMO approach is found to be particul
Externí odkaz:
https://doaj.org/article/b1136c18ab8b4c7bb47237fb738a0fd5
Autor:
MILJENKO PERIC, STANKA JEROSIMIC
Publikováno v:
Journal of the Serbian Chemical Society, Vol 68, Iss 4-5, Pp 363-381 (2003)
The electronic states of the acetylene molecule are classified employing the group theory combined with the use of the Walsh diagrams and some elementary quantum chemical considerations. The results of this analysis are compared with those obtained b
Externí odkaz:
https://doaj.org/article/fadb8d8390724deabd30fef471f189a2
Autor:
MARIJA KRMAR, MILJENKO PERIC
Publikováno v:
Journal of the Serbian Chemical Society, Vol 66, Iss 9, Pp 613-630 (2001)
A systematic study of various effects on the structure of the spectra of linear triatomic molecules in the 3P electronic states has been carried out. Paricular attention was paid to the interplay between the vibronic and spin-orbit couplings. Variati
Externí odkaz:
https://doaj.org/article/e6933a0df2e54354b6fe807033df1838
Publikováno v:
Journal of the Serbian Chemical Society, Vol 64, Iss 12, Pp 721-735 (1999)
Low-lying singlet and triplet electronic states of the BeO molecule are calculated by means of the quantum chemical ab initio method. It was found that all states in the energy range from 0 to 50000 cm-1 are of valence character. Particular attention
Externí odkaz:
https://doaj.org/article/c0937ae10a0d482785cec6f7c1150a4e
Autor:
Jelena Radic-Peric, Miljenko Peric
Publikováno v:
Proceedings of the International Thermal Plasma Processes Conference.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::0fbf099f276288942804001a05c79a78
https://doi.org/10.1615/itppc-1998.810
https://doi.org/10.1615/itppc-1998.810
Publikováno v:
Journal of the Serbian Chemical Society, Vol 70, Iss 3, Pp 423-439 (2005)
The present paper reviews the results of ab initio studies on the magnetic hyperfine structure in spectra of spatially and spin degenerate electronic states of triatomic and tetra-atomic molecules. The main goal of the present paper is to show that s
Externí odkaz:
https://doaj.org/article/cd78605a4282478aa74303544ad7b3f1
Publikováno v:
Journal of the Serbian Chemical Society, Vol 83, Iss 4, Pp 439-448 (2018)
A variational approach for ab initio handling of the Renner–Teller effect in six-atomic molecules with linear equilibrium geometry is elaborated. A very simple model Hamiltonian suitable for the description of small-amplitude bending vibrations in
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::59680c41ead100fd76e5a0a480c48732
https://doi.org/10.2298/jsc171129001m
https://doi.org/10.2298/jsc171129001m
Publikováno v:
Molecular Physics. 97:731-742
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9fb1733a994f7c89ad462680962cd4b4
https://doi.org/10.1080/002689799163352
https://doi.org/10.1080/002689799163352
Publikováno v:
Molecular Physics. 97:743-751
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::89d53b43b984d5fefd97b02be96da6ff
https://doi.org/10.1080/002689799163361
https://doi.org/10.1080/002689799163361