Facultade de Química
Centro
Antonio
Vila Vilariño
Publicacións nas que colabora con Antonio Vila Vilariño (31)
2013
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Anomeric effect in halogenated methanols: A quantum theory of atoms in molecules study
Journal of Physical Chemistry A, Vol. 117, Núm. 7, pp. 1641-1650
2011
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Electronic interpretation of conformational preferences in benzyl derivatives and related compounds
Journal of Physical Chemistry A, Vol. 115, Núm. 45, pp. 13088-13095
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Influence of the solvent on the charge distribution of anomeric compounds
Journal of Physical Chemistry A, Vol. 115, Núm. 10, pp. 1964-1970
2010
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On the non-planarity of 1,3-dioxole and 1,3-dioxolane
Chemical Physics Letters, Vol. 488, Núm. 1-3, pp. 17-21
2007
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Atoms in molecules interpretation of the anomeric effect in the O - C - O unit
Journal of Computational Chemistry, Vol. 28, Núm. 9, pp. 1516-1530
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Interpretation of anomeric effect in the N-C-N unit with the quantum theory of atoms in molecules
Journal of Physical Chemistry A, Vol. 111, Núm. 34, pp. 8491-8499
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QTAIM explanation of the anomeric effect in the O-C-O unit II: 2-Methoxyoxane and 2,2-dimethoxypropane
Chemical Physics Letters, Vol. 443, Núm. 1-3, pp. 22-28
2006
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Are the hydrogen bonds involving sulfur bases inverse or anomalous?
International Journal of Quantum Chemistry, Vol. 106, Núm. 4, pp. 928-934
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On the electronic origin of strain energy: QTAIM study of perfluorocycloalkanes
Journal of Physical Chemistry A, Vol. 110, Núm. 41, pp. 11752-11759
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Topological characterisation of intermolecular lithium bonding
Chemical Physics, Vol. 326, Núm. 2-3, pp. 401-408
2005
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QTAIM study of the electronic structure and strain energy of fluorine substituted oxiranes and thiiranes
Chemical Physics Letters, Vol. 405, Núm. 4-6, pp. 440-447
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Quantum theory of atoms in molecules analysis on the conformational preferences of vinyl alcohol and related ethers
Journal of Physical Chemistry A, Vol. 109, Núm. 31, pp. 6985-6989
2003
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AIM interpretation of strain energy of oxiranes
Chemical Physics, Vol. 287, Núm. 1-2, pp. 125-135
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AIM study on the influence of fluorine atoms on the alkyl chain
Chemical Physics, Vol. 287, Núm. 1-2, pp. 227-236
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AIM study on the protonation of methyl oxiranes
Chemical Physics Letters, Vol. 371, Núm. 5-6, pp. 540-547
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On the different origin of the stabilisation of oxygen versus sulphur H-bond complexes with water
Chemical Physics, Vol. 291, Núm. 1, pp. 73-80
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Theoretical binding enthalpies and topological analysis of complexes of linear and cyclic ethers with Li+, Na+ and K+
Chemical Physics Letters, Vol. 375, Núm. 5-6, pp. 499-505
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Transferability of energies of atoms in organic molecules
Chemical Physics Letters, Vol. 371, Núm. 5-6, pp. 739-743
2002
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AIM electron density analysis on the structure and bonding in oxiranes
Journal of Molecular Structure: THEOCHEM, Vol. 586, Núm. 1-3, pp. 47-56
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Electron density characterisation of intermolecular interactions in the formaldehyde dimer and trimer
Chemical Physics, Vol. 281, Núm. 1, pp. 11-22