QUÍMICA TEÓRICA Y COMPUTACIONAL
QTCOVI
Centre National de la Recherche Scientifique
París, FranciaPublicaciones en colaboración con investigadores/as de Centre National de la Recherche Scientifique (7)
2019
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A chemical theory of topological insulators
Chemical Communications, Vol. 55, Núm. 82, pp. 12281-12287
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A first step towards quantum energy potentials of electron pairs
Physical Chemistry Chemical Physics, Vol. 21, Núm. 8, pp. 4215-4223
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Nine questions on energy decomposition analysis
Journal of Computational Chemistry, Vol. 40, Núm. 26, pp. 2248-2283
2015
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A view of covalent and ionic bonding from Maximum Probability Domains
Computational and Theoretical Chemistry, Vol. 1053, pp. 142-149
1998
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Theoretical study of the [2+2] cycloaddition of thioketenes with imines to form β-thiolactams
Chemistry - A European Journal, Vol. 4, Núm. 2, pp. 328-334
1995
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Solvent effects on the stereoselectivity of ketene-imine cycloaddition reactions
Journal of the Chemical Society, Chemical Communications, pp. 1677-1678
1994
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Solvent effects on hetero Diels-Alder reactions of sulfur dioxide with 1,3-dienes
Journal of the Chemical Society, Chemical Communications, pp. 1683-1684