|
List of selected publications
 cover of the issue: E. Fois, G. Tabacchi, G.
Calzaferri, “Interactions, Behavior, And Stability of Fluorenone inside
Zeolite Nanochannels”, J. Phys. Chem. C 2010,
114, 10572.
 L. Giussani, E. Fois, E. Gianotti, G.
Tabacchi, A. Gamba, S. Coluccia, “On the Compatibility Criteria for
Protein Encapsulation inside Mesoporous Materials”, ChemPhysChem 2010, 11, 1757. (ChemPubSoc Europe and
other spotlights 1 , 2)
 Frontispiece
& Hot paper: "Hot" Surface
Activation of Molecular Complexes: Insight from Modeling Studies, E.
Fois, G. Tabacchi, D. Barreca, A. Gasparotto, E. Tondello, Angew. Chem., 2010, 122, 1988; Angew. Chem. Int. Ed., 2010, 49, 1944. (highlighted on the Nature Chemistry website; Wiley Surface and Interfaces hot
topic)
 A. Gamba, G. Tabacchi, E. Fois,“TS-1
from First Principles”, J. Phys. Chem. A 2009, 113, 15006.
 A. Tilocca, E. Fois, “The Color and
Stability of Maya Blue: TDDFT calculations”, J. Phys. Chem. C, 2009, 113, 8683.
hot
article: G. Bandoli, D. Barreca, A.
Gasparotto, R. Seraglia, E. Tondello, A. Devi, R.A. Fischer, M. Winter,
E. Fois, A. Gamba, G. Tabacchi, “An integrated experimental and
theoretical investigation on Cu(hfa)2·TMEDA: structure, bonding and
reactivity”, Phys. Chem.
Chem. Phys. 2009, 11, 5998.
G. Tabacchi, D. Zucchini, G. Caprini, A.
Gamba, F. Lederer, M.A. Vanoni, E. Fois, “L-Lactate dehydrogenation in
flavocytochrome b(2) - A first principles molecular dynamics study”, FEBS Journal 2009, 276, 2368.
 G. Tabacchi, A. Gamba, E. Fois,
“Intracage Chemistry in Zeolitic Systems: The Car-Parrinello Approach”.
In: Basiuk V.A., Ugliengo P., eds: Quantum Chemical Calculations of
Surfaces and Interfaces of Materials p. 65-87, Stevenson Ranch,
California 91: American Scientific Publishers, 2009, ISBN/ISSN:
1-58883-138-8.
 E. Fois, A. Gamba, G. Tabacchi,
“Influence of silanols condensation on surface properties of micelle
templated silicas: A modelling study”, Microp.
Mesop. Mater. 2008, 116, 518.
 cover
of the issue: E. Fois, A. Gamba, G. Tabacchi, “Bathochromic effects in
electronic excitation spectra of hydrated Ti zeolites: A theoretical characterization”,
ChemPhysChem 2008, 9, 538.
 F. Trudu, G. Tabacchi, A. Gamba, E.
Fois, “First principles studies on boron sites in Zeolites”, J. Phys. Chem. A 2007,
111, 11626.
G. Tabacchi, M.A. Vanoni, A. Gamba, E.
Fois, “Does negative hyperconjugation assist enzymatic
dehydrogenations?”, ChemPhysChem 2007, 8, 1283.
G. Tabacchi, E. Gianotti, E. Fois, G. Martra, L. Marchese, S.
Coluccia, A. Gamba, “Understanding the vibrational and electronic
features of Ti(IV) sites in mesoporous silicas by integrated ab initio
and spectroscopic investigations”, J. Phys. Chem. C 2007,
111, 4946.
E. Spano, G. Tabacchi, A. Gamba, E.
Fois, “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 principles study”, J. Phys. Chem. B 2006,
110, 21651.
E. Fois, A. Gamba, C. Medici, G.
Tabacchi, “Intermolecular electronic excitation transfer in a confined
space: A first-principles study”, ChemPhysChem 2005, 6, 1917.
E. Fois, A. Gamba, G.
Tabacchi, “Electronic spectra of Ti(IV) in zeolites: An ab initio
approach”, ChemPhysChem 2005, 6, 12.
Full publications list (up to
2009) (pdf format)
 
home
|
