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1 |
Material Type: Artigo
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A ‘donor-free’ chromophore with a silicon-based acceptor group for second order nonlinear opticsOrbelli Biroli, A. ; Tessore, F. ; Di Carlo, G. ; Righetto, S. ; Forni, A. ; Fantucci, P. ; Pizzotti, M.Inorganica Chimica Acta, 2022-04, Vol.533, p.120745, Article 120745 [Periódico revisado por pares]Amsterdam: Elsevier B.VTexto completo disponível |
2 |
Material Type: Artigo
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Fast and facile sonochemical synthesis of Mg- and Zn-doped PbS nanospheres: optical properties and photocatalytic activityAndrade Neto, N. F. ; Ramalho, O. B. M. ; Fantucci, H. ; Santos, R. M. ; Bomio, M. R. D. ; Motta, F. V.Journal of materials science. Materials in electronics, 2020-09, Vol.31 (17), p.14192-14202 [Periódico revisado por pares]New York: Springer USTexto completo disponível |
3 |
Material Type: Artigo
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Density functional study of structural and electronic properties of bimetallic silver–gold clusters: Comparison with pure gold and silver clustersBonačić-Koutecký, Vlasta ; Burda, Jaroslav ; Mitrić, Roland ; Ge, Maofa ; Zampella, Giuseppe ; Fantucci, PiercarloThe Journal of chemical physics, 2002-08, Vol.117 (7), p.3120-3131 [Periódico revisado por pares]Texto completo disponível |
4 |
Material Type: Artigo
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Density Functional Calculations of Magnetic Exchange Interactions in Polynuclear Transition Metal ComplexesBencini, Alessandro ; Totti, Federico ; Daul, Claude A ; Doclo, Karel ; Fantucci, Piercarlo ; Barone, VincenzoInorganic chemistry, 1997-10, Vol.36 (22), p.5022-5030 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
5 |
Material Type: Artigo
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Quadratic Hyperpolarizability Enhancement of para-Substituted Pyridines upon Coordination to Organometallic Moieties: The Ambivalent Donor or Acceptor Role of the MetalROBERTO, Dominique ; UGO, Renato ; BRUNI, Silvia ; CARIATI, Elena ; CARIATI, Franco ; FANTUCCI, PierCarlo ; INVERNIZZI, Ivana ; QUICI, Silvio ; LEDOUX, Isabelle ; ZYSS, JosephOrganometallics, 2000-05, Vol.19 (9), p.1775-1788 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
6 |
Material Type: Artigo
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Theoretical Study of Hydration of Cyanamide and CarbodiimideTordini, Francesco ; Bencini, Alessandro ; Bruschi, Maurizio ; De Gioia, Luca ; Zampella, Giuseppe ; Fantucci, PiercarloThe journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2003-02, Vol.107 (8), p.1188-1196 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
7 |
Material Type: Artigo
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Effect of the Coordination to M(II) Metal Centers (M = Zn, Cd, Pt) on the Quadratic Hyperpolarizability of Various Substituted 5-X-1,10-phenanthrolines (X = Donor Group) and of trans-4-(Dimethylamino)-4‘-stilbazoleRoberto, Dominique ; Ugo, Renato ; Tessore, Francesca ; Lucenti, Elena ; Quici, Silvio ; Vezza, Stefano ; Fantucci, PierCarlo ; Invernizzi, Ivana ; Bruni, Silvia ; Ledoux-Rak, Isabelle ; Zyss, JosephOrganometallics, 2002-01, Vol.21 (1), p.161-170 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
8 |
Material Type: Artigo
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Ab Initio Investigation of Gadolinium Complexes with Polyamino Carboxylate Ligands and Force Fields Parametrization of Metal−Ligand InteractionsCosentino, Ugo ; Moro, Giorgio ; Pitea, Demetrio ; Villa, Alessandra ; Fantucci, Pier Carlo ; Maiocchi, Alessandro ; Uggeri, FulvioThe journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 1998-06, Vol.102 (24), p.4606-4614 [Periódico revisado por pares]American Chemical SocietyTexto completo disponível |
9 |
Material Type: Artigo
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Ab initio Hartree-Fock molecular dynamics with parallel processing: application to small neutral and charged Li n clustersFantucci, P. ; Bonačić-Koutecký, V. ; Jellinek, J. ; Wiechert, M. ; Harrison, R.J. ; Guest, M.F.Chemical physics letters, 1996-02, Vol.250 (1), p.47-58 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |
10 |
Material Type: Artigo
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Axial Imidazole Distortion Effects on the Catalytic and Binding Properties of Chelated Deuterohemin ComplexesCasella, Luigi ; Monzani, Enrico ; Fantucci, Piercarlo ; Gullotti, Michele ; De Gioia, Luca ; Strini, Alberto ; Chillemi, FrancescoInorganic chemistry, 1996-01, Vol.35 (2), p.439-444 [Periódico revisado por pares]United States: American Chemical SocietyTexto completo disponível |