Browsing by Author Sanna, Nico


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Issue DateTitleAuthor(s)
2022Benchmarking Plane Waves Quantum Mechanical Calculations of Iron(II) Tris(2,2<sup>′</sup>-bipyridine) Complex by X-ray Absorption SpectroscopySanna, Nico ; Benfatto, Maurizio
2012CALCOLO AD ALTE PRESTAZIONI PER LA MODELLISTICA ELETTROMAGNETICA DI AEROMOBILIDantonio, M.; Donorio De Meo, P.; Paoletti, D.; Sanna, Nico ; Castrignan, T.
2012CALCOLO TECNICO-SCIENTIFICO IN AMBIENTE WINDOWSFederico, A.; Rosati, M.; Sanna, Nico 
1995Calculation of Integral Cross-sections For Vibrationally Inelastic Electron-methane ScatteringAlthorpe Sc; Gianturco Fa; Sanna, Nico 
1994CALCULATION OF LOW-ENERGY ELASTIC CROSS-SECTIONS FOR ELECTRON-CF4 SCATTERINGGianturco Fa; Lucchese Rr; Sanna, Nico 
2008Can a synthetic thread act as an electrochemically switchable molecular device?Zazza, C.; Amadei, A.; Sanna, Nico ; Aschi, M.
2008Catalytic activity of silica surfaces in dissociated oxygen/nitrogen from ab initio calculationsCacciatore, M.; Rutigliano, M.; Pieretti, A.; Sanna, Nico ; Zazza, C.
2020Classifying the chemical bonds involving the noble-gas atomsBorocci, Stefano ; Grandinetti, Felice ; Nunzi, Francesca; Sanna, Nico 
2001The close-coupling-single center-expansion (CC-SCE) model for electron scattering from polyatomic targetsCurik, R.; Gianturco Fa; Sanna, Nico 
2020Complexes of helium with neutral molecules: Progress toward a quantitative scale of bonding characterBorocci, S.; Grandinetti, F.; Sanna, Nico ; Antoniotti, P.; Nunzi, F.
2020Complexes of helium with neutral molecules: Progress toward a quantitative scale of bonding characterBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico ; Antoniotti, Paola; Nunzi, Francesca
2023Complexes of NgHNg+ (Ng = He, Ne, Ar) with He: Theoretical insights into structure, stability, and bonding characterBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico 
2024Complexes of the noble-gas atoms with borazine: Theoretical insights into structure, stability, and bonding characterBorocci, Stefano ; Camerlingo, Armando; Grandinetti, Felice ; Rutigliano, Maria; Sanna, Nico 
2020Complexes of the noble-gas atoms with unsaturated ions: A theoretical investigation on the exemplary (H<inf>2</inf>C = NH<inf>2</inf><sup>+</sup>)ArBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico 
2010Compound I in Horseradish Peroxidase EnzymeZazza Costantino; Sanna, Nico ; Tatoli Simone; Aschi Massimiliano; Palma Amedeo
2005Computational evidence for a variable first shell coordination of the cadmium(II) ion in aqueous solutionChillemi, G.; Barone, V.; Dangelo, P.; Mancini, G.; Persson, I.; Sanna, Nico 
2022Computational Exploration of the Synergistic Anticancer Effect of a Multi-Action Ru(II)-Pt(IV) ConjugateScoditti, Stefano; Mazzone, Gloria; Sanna, Nico ; Sicilia, Emilia
2010Computational Study on Compound I Redox-Active Species in Horseradish Peroxydase EnzymeZazza Costantino; Palma Amedeo; Sanna, Nico ; Tatoli Simone; Aschi Massimiliano
1999Computed elastic cross sections and angular distributions of low-energy electron scattering from gas phase C-60 fullereneGianturco Fa; Lucchese Rr; Sanna, Nico 
2021Concerning the role of σ-Hole in non-covalent interactions: insights from the study of the complexes of ArBeO with simple ligandsBorocci, Stefano ; Grandinetti, Felice ; Sanna, Nico