Sfoglia per Autore
Photoionization of M@C60 (M=Li,Na,K) by large scale one centre density functional explicit continuum wavefunction
1999-01-01 Stener, Mauro; Fronzoni, Giovanna; M., Venuti; Decleva, Pietro
Theoretical study of the excited and continuum states in the NEXAFS region of Cl2
1999-01-01 Fronzoni, Giovanna; Stener, Mauro; Decleva, Pietro
Theoretical study of the photoionization shape resonances of Cobaltocene and Nickelocene
2001-01-01 Fronzoni, Giovanna; Stener, Mauro; S., Furlan; Decleva, Pietro
High-resolution inner-shell photoabsorption and dissociation of Ozone.
2001-01-01 S., Stranges; M., Alagia; Fronzoni, Giovanna; Decleva, Pietro
Theoretical study of photoionization processes in Fe(C5H5)2
2001-01-01 Fronzoni, Giovanna; P., Colavita; Stener, Mauro; DE ALTI, Giancarlo; Decleva, Pietro
Complexed bridging ligands: oxorhenium(V) compounds with mono-coordinated pyrazine or pyrimidine as possible building-blocks for the construction of polynuclear architectures.
2001-01-01 Iengo, Elisabetta; Zangrando, Ennio; Mestroni, S; Fronzoni, Giovanna; Stener, Mauro; Alessio, Enzo
High energy oscillations in the valence photoionization partial cross section of C60
2001-01-01 Decleva, Pietro; S., Furlan; Fronzoni, Giovanna; Stener, Mauro
Theoretical study of the valence and core photoemission spectra of C60.
2001-01-01 Fronzoni, Giovanna; P., Colavita; Stener, Mauro; DE ALTI, Giancarlo; Decleva, Pietro
Photoionization of [(C6H6)2Cr] with the explicit continuum B-spline density functional method
2001-01-01 Stener, Mauro; Fronzoni, Giovanna; S., Furlan; Decleva, Pietro
Time Dependent Density Functional Photoionization of CH4, NH 3, H2O and HF
2002-01-01 Stener, Mauro; Fronzoni, Giovanna; Toffoli, Daniele; Decleva, Pietro
Time Dependent Density Functional Study of the Symmetry Resolved N1s Photoionization in N2
2002-01-01 Stener, Mauro; Fronzoni, Giovanna; Decleva, Pietro
Valence and Core Photoemission in M@C60 (M=Be, Mg, Ca)
2002-01-01 Stener, Mauro; Fronzoni, Giovanna; Toffoli, Daniele; P., Colavita; S., Furlan; Decleva, Pietro
Convergence of the multicenter B-spline DFT approach for the continuum
2002-01-01 Toffoli, Daniele; Stener, Mauro; Fronzoni, Giovanna; Decleva, Pietro
Dramatic Response Effects in the photoionization of the second row hydrides: a time dependent density functional investigation.
2003-01-01 Fronzoni, Giovanna; Stener, Mauro; Decleva, Pietro
High Resolution Inner-Shell Spectroscopy and ab-initio CI calculations on TiCl4 and isoelectronic molecules.
2003-01-01 Fronzoni, Giovanna; M., Coreno; M., DE SIMONE; P., Franceschi; C., Furlani; S., Furlan; K. C., Prince; Stener, Mauro; Decleva, Pietro
Time Dependent Density Functional Theory of Core Electrons Excitations
2003-01-01 Stener, Mauro; Fronzoni, Giovanna; M., DE SIMONE
Time Dependent Density Functional Theory Calculations of Ligand K-Edge and Metal L-Edge X-Ray absorption of a series of Oxomolybdenum Complexes
2004-01-01 Fronzoni, Giovanna; Stener, Mauro; A., Reduce; Decleva, Pietro
Valence and core photoionization dynamics of Acetylene by TD-DFT continuum approach
2004-01-01 Fronzoni, Giovanna; Stener, Mauro; Decleva, Pietro
Circular Dichroism in photoelectron spectroscopy of Free Chiral Molecules: Experiment and Theory on Methyl-oxirane
2004-01-01 Turchini, S.; Zema, N.; Contini, G.; Alberti, G.; Alagia, M.; Stranges, S.; Fronzoni, Giovanna; Stener, Mauro; Decleva, Pietro; Prosperi, T.
Palladium complexes with 3-alkyl-substituted-1,10-phenanthrolines: effect of the remote alkyl substituent on the CO/olefin copolymerization reactions
2004-01-01 A., Scarel; Milani, Barbara; Zangrando, Ennio; Stener, Mauro; S., Furlan; Fronzoni, Giovanna; G. MESTRONI S., Gladiali; C., Carfagna; L., Mosca
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