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Showing 10 out of a total of 149 results for community: Producció científica. (0.01 seconds)

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Use of metalloligands [CuL] (H2L = salen type di-Schiff bases) in the formation of heterobimetallic copper(II)-uranyl complexes: Photo-physical investigations, structural variations and theoretical calculations

Ghosh, Soumavo; Biswas, Saptarshi; Bauzá Riera, Antonio; Barceló Oliver, Miquel; Frontera Beccaria, Antonio; Ghosh Ashutosh
The different nature of the interactions between anions and HAT(CN)6: from reversible anion-pi complexes to irreversible electron transfer processes (HAT(CN)6 = 1,4,5,8,9,12-hexaazatriphenylene)

Aragay, Gemma; Frontera Beccaria, Antonio; Lloveras, Vega; Vidal-Gancedo, José; Ballester Balaguer, Pablo José
Influence of accompanying anions on supramolecular assembly and coordination geometry in HgII complexes with 8-aminoquinoline: experimental and theoretical studies

Mirzaei, M.; Eshtiagh-Hosseini, H.; Mohammadi Abadeh, M.; Chahkandi, M.; Frontera Beccaria, Antonio; Hassanpoor, Azam
Internal rotation in squaramide and related compounds. A theoretical ab initio study

Deyà Serra, Pere Maria; Frontera Beccaria, Antonio; Suñer, Guillem A.; Quiñonero Santiago, David; Garau Rosselló, Carolina; Costa Torres, Antonio; Ballester Balaguer, Pablo José
Synthesis, structure and DFT studies of a chelidamic acid based Cu coordination polymer: On the importance of pi-pi interactions and hexameric water cluster

Mirzaei, Masoud; Eshtiagh-Hosseini, Hosseine; Karrabi, Zahra; Notash, Behrouz; Bauzá Riera, Antonio; Frontera Beccaria, Antonio
Application of a novel 2D cadmium(II)-MOF in the formation of a photo-switch with substantial onoff ratio

Roy, Sumit; Dey, Arka; Ray, Partha Patrim; Ortega-Castro, Joaquin; Frontera Beccaria, Antonio; Chattopadhyay, Shouvick
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
Computational study of anion recognition based on tetrel and hydrogen bonding interaction by calix[4]pyrrole derivatives

Bauzá Riera, Antonio; Ramis Cortés, Rafael; Frontera Beccaria, Antonio
s-Tetrazine as a New Binding Unit in Molecular Recognition of Anions

Garau Rosselló, Carolina; Quiñonero Santiago, David; Frontera Beccaria, Antonio; Costa Torres, Antonio; Ballester Balaguer, Pablo José; Deyà Serra, Pere Maria

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