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Can lone pair-pi and cation-pi interactions coexist? A theoretical study

Estarellas, Carolina; Frontera Beccaria, Antonio; Quiñonero, David; Deyà Serra, Pere Maria (De Gruyter Open/ Versita, 2011)
Molecular interaction potential with polarization (MIPp) study of the interplay between anion-pi and hydrogen bonding interactions.

Quiñonero, David; Escudero, Daniel; Frontera Beccaria, Antonio; Deyà Serra, Pere Maria (Bentham Science Publishers Ltd., )
Self-assembly of [2]Rotaxane exploiting Reversible Pt(II)-Pyridine Coordinate Bonds

Ballester Balaguer, Pablo José; Capó, Magdalena; Costa Torres, Antonio; Deyà Serra, Pere Maria; Frontera Beccaria, Antonio; Gomila Ribas, Rosa Maria (MDPI, )
Substituent Effects in Cation/pi Interactions Revisited: A General Approach from Intrinsic Properties of the Arenes

Bauza Riera, Antonio; Deyà Serra, Pere Maria; Frontera Beccaria, Antonio; Quiñonero Santiago, David
Squaramido-Based Receptors : Applicability of Molecular Interaction Potential to Molecular Recognition of Polyalkylammonium Compounds

Quiñonero Santiago, David; Frontera Beccaria, Antonio; Tomàs, Salvador; Suñer, Guillem A.; Morey Salvà, Jeroni; Costa Torres, Antonio; Ballester Balaguer, Pablo José; Deyà Serra, Pere Maria
Unexpected nonadditivity effects in anion-pi complexes

Estarellas Martín, Carolina; Frontera Beccaria, Antonio; Quiñonero Santiago, David; Deyà Serra, Pere Maria
Interplay between edge-to-face aromatic and hydrogen-bonding interactions

Escudero, Daniel; Frontera Beccaria, Antonio; Quiñonero Santiago, David; Deyà Serra, Pere Maria
Unexpected Binding Affinity of [2.2]Paracyclophane to Cations

Frontera Beccaria, Antonio; Garau Rosselló, Carolina; Quiñonero Santiago, David; Ballester Balaguer, Pablo José; Costa Torres, Antonio; Deyà Serra, Pere Maria
Feasibility of Single-Walled Carbon Nanotubes as Materials for CO2 Adsorption: A DFT Study

Quiñonero Santiago, David; Frontera Beccaria, Antonio; Deyà Serra, Pere Maria
Erroneous behaviour of the widely used MP2(full)/aug-cc-pVXZ (X = D, T) level of theory for evaluating the BSSE in ion-pi complexes

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

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