Structure and energetics of water adsorbed at TiO2 anatase (101) and (001) surfaces A Vittadini, A Selloni, FP Rotzinger, M Grätzel
Physical Review Letters 81 (14), 2954, 1998
1109 1998 Estructura y energética de superficies estequiométricas de TiO2 anatasa M Lazzeri, A Vittadini, A Selloni
Revisión física B 63 (15), 155409, 2001
880 2001 Structure and energetics of stoichiometric TiO 2 anatase surfaces M Lazzeri, A Vittadini, A Selloni
Physical Review B 63 (15), 155409, 2001
862 2001 Role and effective treatment of dispersive forces in materials: Polyethylene and graphite crystals as test cases V Barone, M Casarin, D Forrer, M Pavone, M Sambi, A Vittadini
Journal of computational chemistry 30 (6), 934-939, 2009
824 2009 A series of isoreticular, highly stable, porous zirconium oxide based metal–organic frameworks V Guillerm, F Ragon, M Dan‐Hardi, T Devic, M Vishnuvarthan, B Campo, ...
Angewandte Chemie-International Edition 51 (37), 9267, 2012
511 2012 Formic Acid Adsorption on Dry and Hydrated TiO2 Anatase (101) Surfaces by DFT Calculations A Vittadini, A Selloni, FP Rotzinger, M Grätzel
The Journal of Physical Chemistry B 104 (6), 1300-1306, 2000
503 2000 Theoretical Studies on Anatase and Less Common TiO2 Phases: Bulk, Surfaces, and Nanomaterials F De Angelis, C Di Valentin, S Fantacci, A Vittadini, A Selloni
Chemical reviews 114 (19), 9708-9753, 2014
452 2014 Photoemission and STM study of the electronic structure of Nb-doped D Morris, Y Dou, J Rebane, CEJ Mitchell, RG Egdell, DSL Law, A Vittadini, ...
Physical Review B 61 (20), 13445, 2000
347 2000 Chemistry of and on TiO2 -anatase surfaces by DFT calculations: a partial review A Vittadini, M Casarin, A Selloni
Theoretical Chemistry Accounts 117, 663-671, 2007
292 2007 Density Functional Theory Study of Formic Acid Adsorption on Anatase TiO2 (001): Geometries, Energetics, and Effects of Coverage, Hydration, and Reconstruction XQ Gong, A Selloni, A Vittadini
The Journal of Physical Chemistry B 110 (6), 2804-2811, 2006
276 2006 Small gold clusters on stoichiometric and defected anatase (101) and their interaction with CO: A density functional study A Vittadini, A Selloni
The Journal of chemical physics 117 (1), 353-361, 2002
160 2002 Tuning the catalytic activity of Ag (110)-supported Fe phthalocyanine in the oxygen reduction reaction F Sedona, M Di Marino, D Forrer, A Vittadini, M Casarin, A Cossaro, ...
Nature materials 11 (11), 970-977, 2012
155 2012 Hexakis (acetato) oxotetrazinc, a well-tailored molecular model of zinc oxide. An experimental and theoretical investigation of the electronic structure of Zn4O (acetate) 6 and … R Bertoncello, M Bettinelli, M Casarin, A Gulino, E Tondello, A Vittadini
Inorganic Chemistry 31 (9), 1558-1565, 1992
150 1992 Chemistry of the strong electrophilic metal fragment [99Tc (N)(PXP)] 2+(PXP= diphosphine ligand). A novel tool for the selective labeling of small molecules C Bolzati, A Boschi, L Uccelli, F Tisato, F Refosco, A Cagnolini, A Duatti, ...
Journal of the American Chemical Society 124 (38), 11468-11479, 2002
126 2002 The adsorption of small molecules on the TiO2 anatase (101) surface by first-principles molecular dynamics A Selloni, A Vittadini, M Grätzel
Surface science 402, 219-222, 1998
125 1998 Molecular Chemisorption on TiO2 (110): A Local Point of View M Casarin, C Maccato, A Vittadini
The Journal of Physical Chemistry B 102 (52), 10745-10752, 1998
123 1998 Binding Sites, Migration Paths, and Barriers for Hydrogen on Si(111)-(7 7) A Vittadini, A Selloni
Physical review letters 75 (26), 4756, 1995
97 1995 Bottom-Up Assembly of Single-Domain Titania Nanosheets on T Orzali, M Casarin, G Granozzi, M Sambi, A Vittadini
Physical review letters 97 (15), 156101, 2006
95 2006 Density functional study of H2 desorption from monohydride and dihydride Si (100) surfaces A Vittadini, A Selloni
Chemical physics letters 235 (3-4), 334-340, 1995
93 1995 Energetics of atomic hydrogen diffusion on Si (100) A Vittadini, A Selloni, M Casarin
Surface Science Letters 289 (3), L625-L630, 1993
92 1993