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Bernardi, Fernando, Bottoni, Andrea, Venturini, Alessandro (1988) An ab initio SCF-MO study of the aromaticity of some cyclic compounds. Journal of Molecular Structure: THEOCHEM, 163. 173-189 doi:10.1016/0166-1280(88)80389-0

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Reference TypeJournal (article/letter/editorial)
TitleAn ab initio SCF-MO study of the aromaticity of some cyclic compounds
JournalJournal of Molecular Structure: THEOCHEM
AuthorsBernardi, FernandoAuthor
Bottoni, AndreaAuthor
Venturini, AlessandroAuthor
Year1988 (January)Volume163
PublisherElsevier BV
DOIdoi:10.1016/0166-1280(88)80389-0Search in ResearchGate
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Mindat Ref. ID8778269Long-form Identifiermindat:1:5:8778269:5
GUID0
Full ReferenceBernardi, Fernando, Bottoni, Andrea, Venturini, Alessandro (1988) An ab initio SCF-MO study of the aromaticity of some cyclic compounds. Journal of Molecular Structure: THEOCHEM, 163. 173-189 doi:10.1016/0166-1280(88)80389-0
Plain TextBernardi, Fernando, Bottoni, Andrea, Venturini, Alessandro (1988) An ab initio SCF-MO study of the aromaticity of some cyclic compounds. Journal of Molecular Structure: THEOCHEM, 163. 173-189 doi:10.1016/0166-1280(88)80389-0
In(n.d.) Journal of Molecular Structure: THEOCHEM Vol. 163. Elsevier BV

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Bernardi, Fernando, Bottoni, Andrea, Mangini, Angelo, Tonachini, Glauco (1981) Quantitative orbital analysis of ab initio SCFMO computations. Journal of Molecular Structure: THEOCHEM, 86. 163-172 doi:10.1016/0166-1280(81)85082-8
Bernardi, Fernando, Bottoni, Andrea, Tonachini, Glauco (1981) A comparative analysis of various gradient methods for geometry optimization at the ab initio SCF-MO level. Journal of Molecular Structure: THEOCHEM, 86. 123-129 doi:10.1016/0166-1280(81)85078-6
Bernardi, Fernando, Pappalardo, Rafael R., Robb, Michael A., Venturini, Alessandro (1995) An ab initio MC-SCF study of the solvent effects in polar and non-polar [2 + 2] cycloadditions. Journal of Molecular Structure: THEOCHEM, 357. 33-36 doi:10.1016/0166-1280(95)04276-c
Bernardi, Fernando, Fossey, Jacques (1988) An ab initio study of the structural properties of β-substituted ethyl-free radicals. Journal of Molecular Structure: THEOCHEM, 180. 79-93 doi:10.1016/0166-1280(88)80080-0
Bernardi, Fernando, Bottoni, Andreà, Fossey, Jacques, Sorba, Janine (1989) Fragment interaction analysis in the framework of ab-initio UHF-MO computations. Journal of Molecular Structure: THEOCHEM, 183. 301-309 doi:10.1016/0166-1280(89)80011-9
Bernardi, Fernando, Suzzi Valli, Giorgio, Venturini, Alessandro (1989) An ab-initio SCF-MO study of the solvent effect in α-substituted carbanions. Journal of Molecular Structure, 198. 489-497 doi:10.1016/0022-2860(89)80059-6
Bernardi, Fernando, Bottoni, Andrea, Olivucci, Massimo, Venturini, Alessandro, Robb, Michael A. (1994) Ab initio MC-SCF study of thermal and photochemical [2 + 2] cycloadditions. Journal of the Chemical Society, Faraday Transactions, 90. 1617pp. doi:10.1039/ft9949001617
Hinchliffe, Alan (1983) Hydrogen bonding in ethene ⋯ HCN and ethyne ⋯ HCN: An ab initio SCF-MO study. Journal of Molecular Structure: THEOCHEM, 104. 421-425 doi:10.1016/0166-1280(83)80190-0
Bernardi, Fernando, Bottoni, Andrea, Olivucci, Massimo, McDouall, Joseph J.W., Robb, Michael A., Tonachini, Glauco (1988) Potential energy surfaces of cycloaddition reactions. Journal of Molecular Structure: THEOCHEM, 165. 341-351 doi:10.1016/0166-1280(88)87031-3
Hinchliffe, Alan (1984) Hydrogen bonding in cyclopropane⋯HCN; an ab initio SCF-MO study. Journal of Molecular Structure: THEOCHEM, 108. 313-316 doi:10.1016/0166-1280(84)85016-2
Bernardi, F., Bottoni, A., Fossey, J., Sorba, J. (1985) Fragment interaction analysis in the framework of ab initio UHF MO computations. Journal of Molecular Structure: THEOCHEM, 119. 231-239 doi:10.1016/0166-1280(85)87001-9
 
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