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Showing 7 out of a total of 7 results. (0.004 seconds)

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Substituent effects in halogen bonding complexes between aromatic donors and acceptors: a comprehensive ab initio study

Bauzá Riera, Antonio; Quiñonero Santiago, David; Frontera Beccaria, Antonio; Deyà Serra, Pere Maria
Synthesis, X-Ray structure analysis and computational studies of novel Bis(thiocarbamoyl) Disulfides with non-covalent S···N and S···S interactions

Saczewski, Jaroslaw; Frontera Beccaria, Antonio; Gdaniec, Maria; Brzozowski, Zdzislaw; Saczewski, Franciszek; Tabin, Piotr; Quiñonero Santiago, David; Deyà Serra, Pere Maria
Is the use of diffuse functions essential for the properly description of noncovalent interactions involving anions?

Bauzá Riera, Antonio; Quiñonero Santiago, David; Deyà Serra, Pere Maria; Frontera Beccaria, Antonio
Anion-pi interactions in [S4N3]+ rings

Bauzá Riera, Antonio; Quiñonero Santiago, David; Deyà Serra, Pere Maria; Frontera Beccaria, Antonio
Interplay between cation-pi and hydrogen bonding interactions: Are non-additivity effects additive?

Estarellas Martín, Carolina; Frontera Beccaria, Antonio; Quiñonero Santiago, David; Deyà Serra, Pere Maria
Estimating ring strain energies in small carbocycles by means of the Bader's theory of 'atoms-in-molecules'

Bauzá Riera, Antonio; Quiñonero Santiago, David; Deyà Serra, Pere Maria; Frontera Beccaria, Antonio
Counterintuitive Substituent Effect of the Ethynyl Group in Ion-pi Interactions

Lucas, Xavier; Quiñonero Santiago, David; Frontera Beccaria, Antonio; Deyà Serra, Pere Maria

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