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gloria tabacchi
gloria tabacchi
在 uninsubria.it 的电子邮件经过验证
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CP2K: An electronic structure and molecular dynamics software package-Quickstep: Efficient and accurate electronic structure calculations
TD Kühne, M Iannuzzi, M Del Ben, VV Rybkin, P Seewald, F Stein, ...
The Journal of Chemical Physics 152 (19), 2020
20862020
First-principles study of aqueous hydroxide solutions
B Chen, JM Park, I Ivanov, G Tabacchi, ML Klein, M Parrinello
Journal of the American Chemical Society 124 (29), 8534-8535, 2002
992002
Classical polarizable force fields parametrized from ab initio calculations
G Tabacchi, CJ Mundy, J Hutter, M Parrinello
The Journal of chemical physics 117 (4), 1416-1433, 2002
872002
Shape-controlled TiO 2 nanoparticles and TiO 2 P25 interacting with CO and H 2 O 2 molecular probes: a synergic approach for surface structure recognition and physico-chemical …
C Deiana, M Minella, G Tabacchi, V Maurino, E Fois, G Martra
Physical Chemistry Chemical Physics 15 (1), 307-315, 2013
792013
Structural deformation mechanisms of zeolites under pressure
R Arletti, O Ferro, S Quartieri, A Sani, G Tabacchi, G Vezzalini
American Mineralogist 88 (10), 1416-1422, 2003
782003
Supramolecular organization in confined nanospaces
G Tabacchi
ChemPhysChem 19 (11), 1249-1297, 2018
712018
β-Fe 2 O 3 nanomaterials from an iron (II) diketonate-diamine complex: a study from molecular precursor to growth process
D Barreca, G Carraro, A Devi, E Fois, A Gasparotto, R Seraglia, ...
Dalton Transactions 41 (1), 149-155, 2012
712012
Interactions, behavior, and stability of fluorenone inside zeolite nanochannels
E Fois, G Tabacchi, G Calzaferri
The Journal of Physical Chemistry C 114 (23), 10572-10579, 2010
702010
High-pressure behavior of bikitaite: An integrated theoretical and experimental approach
O Ferro, S Quartieri, G Vezzalini, E Fois, A Gamba, G Tabacchi
American Mineralogist 87 (10), 1415-1425, 2002
692002
The Case of Formic Acid on Anatase TiO2(101): Where is the Acid Proton?
G Tabacchi, M Fabbiani, L Mino, G Martra, E Fois
Angewandte Chemie 131 (36), 12561-12564, 2019
652019
The effect of pressure on open-framework silicates: elastic behaviour and crystal–fluid interaction
GD Gatta, P Lotti, G Tabacchi
Physics and Chemistry of Minerals 45, 115-138, 2018
612018
Host–guest interactions and orientation of dyes in the one-dimensional channels of zeolite L
E Fois, G Tabacchi, A Devaux, P Belser, D Brühwiler, G Calzaferri
Langmuir 29 (29), 9188-9198, 2013
582013
Hot” surface activation of molecular complexes: Insight from modeling studies
E Fois, G Tabacchi, D Barreca, A Gasparotto, E Tondello
Angew. Chem. Int. Ed 49 (11), 1944-1948, 2010
582010
TS-1 from first principles
A Gamba, G Tabacchi, E Fois
The Journal of Physical Chemistry A 113 (52), 15006-15015, 2009
572009
On the collective properties of water molecules in one-dimensional zeolitic channels
E Fois, A Gamba, G Tabacchi, S Quartieri, G Vezzalini
Physical Chemistry Chemical Physics 3 (18), 4158-4163, 2001
562001
Water molecules in single file: first-principles studies of one-dimensional water chains in zeolites
E Fois, A Gamba, G Tabacchi, S Quartieri, G Vezzalini
The Journal of Physical Chemistry B 105 (15), 3012-3016, 2001
552001
Close-packed dye molecules in zeolite channels self-assemble into supramolecular nanoladders
L Gigli, R Arletti, G Tabacchi, E Fois, JG Vitillo, G Martra, G Agostini, ...
The Journal of Physical Chemistry C 118 (29), 15732-15743, 2014
542014
On the role of Ti (IV) as a Lewis acid in the chemistry of titanium zeolites: formation, structure, reactivity, and aging of Ti− peroxo oxidizing intermediates. a first …
E Spanó, G Tabacchi, A Gamba, E Fois
The Journal of Physical Chemistry B 110 (43), 21651-21661, 2006
542006
Structure of Nanochannel Entrances in Stopcock‐Functionalized Zeolite L Composites
G Tabacchi, E Fois, G Calzaferri
Angewandte Chemie 127 (38), 11264-11268, 2015
532015
Orientation and Order of Xanthene Dyes in the One-Dimensional Channels of Zeolite L: Bridging the Gap between Experimental Data and Molecular Behavior
E Fois, G Tabacchi, GA Calzaferri
The Journal of Physical Chemistry C 116 (31), 16784-16799, 2012
532012
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