Raúl Evaristo
Palmeiro Uriach
Profesor/a Contratado/a Doctor/a
Obis Dionisio
Castaño González
Publications dans lesquelles il/elle collabore avec Obis Dionisio Castaño González (9)
2021
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[10]annulene: Electrocyclization mechanisms
Journal of Computational Chemistry, Vol. 42, Núm. 16, pp. 1150-1158
2007
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New valley ridge inflection point associated to the bifurcation of a valley on potential energy surfaces
International Journal of Quantum Chemistry, Vol. 107, Núm. 14, pp. 2687-2696
2002
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Note on the theory of bifurcation of chemical reactions
International Journal of Quantum Chemistry, Vol. 86, Núm. 5, pp. 422-425
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Role of bifurcation in the bond shifting of cyclooctatetraene
Journal of Computational Chemistry, Vol. 23, Núm. 7, pp. 732-736
2000
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Organic thermochemistry at high ab initio levels. 3. A G3 study of cyclic saturated and unsaturated hydrocarbons (including aromatics)
Journal of Organic Chemistry, Vol. 65, Núm. 14, pp. 4298-4302
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The valence isomerization of cyclooctatetraene to semibullvalene
Angewandte Chemie - International Edition, Vol. 39, Núm. 12, pp. 2095-2097
1999
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2-Alkoxycarbonylpyridinium N-aminides: 1,3-Dipoles or 1,4-nucleophile- electrophile synthons? Experimental and theoretical evidence for the mechanism of pyrido[1,2-b]pyridazinium inner salt formation
Journal of Organic Chemistry, Vol. 64, Núm. 25, pp. 9001-9010
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Organic thermochemistry at high ab initio levels. 1. A G2(MP2) and G2 study of cyclic saturated and unsaturated hydrocarbons (including aromatics)
Journal of Organic Chemistry, Vol. 64, Núm. 25, pp. 9011-9014
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Organic thermochemistry at high ab initio levels. 2. Meeting the challenge: Standard heats of formation of gaseous norbornane, 2-norbornene, 2,5-norbornadiene, cubane, and adamantane at the G2 level
Journal of Organic Chemistry, Vol. 64, Núm. 25, pp. 9015-9018