GAMBA, ALDO
GAMBA, ALDO
DIPARTIMENTO DI SCIENZE CHIMICHE E AMBIENTALI - CO (attivo dal 01/01/2004 al 30/09/2011)
A DENSITY FUNCTIONAL-STUDY OF THE ALUMINUM DIMER
1992-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Sironi, M.
A METHOD FOR CORRECTING EMPIRICAL POTENTIALS - APPLICATION TO WATER MOLECULE
1985-01-01 Demontis, P.; Suffritti, G. B.; Fois, ETTORE SILVESTRO; Gamba, Aldo
A molecular dynamics study of the behavior of sodium in low albite
2003-01-01 Alberti, A; Fois, ETTORE SILVESTRO; Gamba, Aldo
A POTENTIAL FOR MOLECULAR-DYNAMICS SIMULATIONS OF STRUCTURAL AND DYNAMIC PROPERTIES OF HYDRATE ALUMINOSILICATES
1991-01-01 Demontis, P.; Suffritti, G. B.; Fois, ETTORE SILVESTRO; Gamba, Aldo; Morosi, G.
A THEORETICAL INVESTIGATION OF ENERGETICS AND STRUCTURES OF CH5+(CH4)N CLUSTERS FOR N = 1-4
1985-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Simonetta, M.
A theoretical investigation of the role of the solvent on the structure of the intermediates in solvolytic reactions. Part 4. Methanediazonium ion and methyl fluoride in hydrofluoric acid
1982-01-01 Demontis, P.; Fois, ETTORE SILVESTRO; Gamba, Aldo; Manunza, B.; Suffritti, G. B.; Simonetta, M.
A theoretical study of the solvent effect on dissociation reactions. The role of the first solvation shell
1983-01-01 Demontis, P.; Fois, ETTORE SILVESTRO; Gamba, Aldo; Manunza, B.; Suffritti, G. B.; Simonetta, M.
Ab initio MD Calculations on Dynamics and Reactivity in confined and disordered Systems
1999-01-01 Gamba, Aldo
Ab initio molecular dynamics simulation of the interaction between water and Ti in zeolitic systems
2004-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Spano', Emanuela
Ab initio molecular dynamics studies of flavocytochrome b2 reduction
2005-01-01 Tabacchi, Gloria; Vanoni, M. A.; Lederer, F.; Gamba, Aldo; Fois, ETTORE SILVESTRO
Ab initio molecular dynamics study of the Bronsted acid site in a gallium zeolite
1999-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Tabacchi, Gloria
Ab initio study of defect sites at the inner surfaces of mesoporous silicas
2003-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Tabacchi, Gloria; Coluccia, S; Martra, G.
AN ABINITIO O-2 ... H2O POTENTIAL FOR MONTE-CARLO AND MOLECULAR-DYNAMICS CALCULATIONS
1987-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Morosi, G.; Demontis, P.; Suffritti, G. B.
AN IMPLEMENTED POTENTIAL OF NONRIGID WATER-MOLECULES FOR MOLECULAR-DYNAMICS SIMULATIONS
1986-01-01 Demontis, P.; Suffritti, G. B.; Fois, ETTORE SILVESTRO; Gamba, Aldo
An integrated experimental and theoretical investigation on Cu(hfa)(2)center dot TMEDA: structure, bonding and reactivity
2009-01-01 G., Bandoli; D., Barreca; A., Gasparotto; R., Seraglia; E., Tondello; A., Devi; R. A., Fischer; M., Winter; Fois, ETTORE SILVESTRO; Gamba, Aldo; Tabacchi, Gloria
b initio and semiempirical study of the energy and geometry of ion-molecule pairs. 5. Vinyldiazonium cation in vacuo and in solution
1982-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Suffritti, G. B.; Simonetta, M.; Szele, I.; Zollinger, H.
Bathochromic effects in electronic excitation spectra of hydrated Ti zeolites: A theoretical characterization
2008-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Tabacchi, Gloria
Can the three-coordinated Mg site of MgO accommodate more than one CO molecule?
2000-01-01 Pelmenschikov, A; Morosi, Gabriele; Gamba, Aldo; Coluccia, S; Martra, G; Pettersson, Lgm
Charge layering in polar liquids
1992-01-01 Bressanini, Dario; Fois, ETTORE SILVESTRO; Gamba, Aldo; Morosi, Gabriele
Competition between water and hydrogen peroxide at Ti center in Titanium zeolites. An ab initio study
2004-01-01 Fois, ETTORE SILVESTRO; Gamba, Aldo; Spano, E.