JOSE MANUEL
HERMIDA RAMON
CATEDRATICO/A UNIVERSIDADE - TEMPO COMPLETO
MARIA DE LOS ANGELES
PEÑA GALLEGO
TITULAR DE UNIVERSIDADE - TEMPO COMPLETO
Publicacións nas que colabora con MARIA DE LOS ANGELES PEÑA GALLEGO (10)
2020
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Using “flipped classroom“ strategies to teach undergraduate courses of quantum chemistry. Application to a modified hückel method including a partial overlap
EDULEARN20 Proceedings: 12th International Conference on Education and New Learning Technologies (July 6th-7th, 2020, Online)
2005
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A DFT study of the pericyclic/pseudopericyclic character of cycloaddition reactions of ethylene and formaldehyde to buta-1,3-dien-1-one and derivatives
Journal of Physical Chemistry A, Vol. 109, Núm. 25, pp. 5636-5644
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A density functional theory study on the electrocyclization of 1,2,4,6-heptatetraene analogues: Converting a pericyclic to a pseudopericyclic reaction
Chemistry - A European Journal, Vol. 11, Núm. 20, pp. 5966-5974
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Are electrocyclization reactions of (3Z)-1,3,5-hexatrienone and nitrogen derivatives pseudopericyclic? A DFT study
Journal of Organic Chemistry, Vol. 70, Núm. 10, pp. 3921-3928
2003
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DFT Study of Pericyclic and Pseudopericyclic Thermal Cheletropic Decarbonylations. Evaluation of Magnetic Properties
Journal of Organic Chemistry, Vol. 68, Núm. 23, pp. 8823-8830
2000
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A quantum chemical study of aniline/ammonia clusters. Thermodynamic properties and frequency analysis
Journal of Molecular Structure: THEOCHEM, Vol. 497, Núm. 1-3, pp. 105-113
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DFT conformational study of cysteine in gas phase and aqueous solution
Journal of Molecular Structure: THEOCHEM, Vol. 498, Núm. 1-3, pp. 191-200
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Intermolecular interactions and cooperative effects in acetonitrile clusters. An ab initio molecular orbital study
Journal of Molecular Structure: THEOCHEM, Vol. 498, Núm. 1-3, pp. 21-28
1999
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A DFT study of a model compound of vitamin D
Journal of Molecular Structure: THEOCHEM, Vol. 492, Núm. 1-3, pp. 143-150
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An ab initio study of a model compound of penicillins
Journal of Molecular Structure: THEOCHEM, Vol. 491, Núm. 1-3, pp. 177-185