2010
- P. Romaniello, M. D\textquoterightAndria, F Lelj Nonlinear Optical Properties of Ni(Me6pzS2)MX (M = Ni, Pd, Pt; X = Me2timdt, mnt) The Journal of Physical Chemistry A 114, 5838-5845 (2010). Export BibTeX External Link.
2007
- P. Romaniello, F Lelj, Massimiliano Arca, FA Devillanova Structural and new spectroscopic properties of neutral [M(dmit)(2)](dmit = (CS52-)-S-3, 1,3-dithiole-2-thione-4,5-dithiolate) and [M(H(2)timdt)(2)](H(2)timdt = H2C3N2S31-, monoanion of imidazolidine-2,4,5-trithione) complexes within the density functional THEORETICAL CHEMISTRY ACCOUNTS 117, 621-635 (2007). Export BibTeX
2004
- P. Romaniello, F Lelj Effects of fluorine atoms on the optical nonlinear response of stilbene derivatives JOURNAL OF FLUORINE CHEMISTRY 125, 145-149 (2004). Export BibTeX
2003
- P. Romaniello, MC Aragoni, M Arca, T Cassano, C Denotti, FA Devillanova, F Isaia, F Lelj, Lippolis V, R Tommasi Ground and excited states of [M(H(2)timdt)(2)] neutral dithiolenes (M = Ni, Pd, Pt; H(2)timdt = monoanion of imidazolidine-2,4,5-trithione): Description within TDDFT and scalar relativistic (ZORA) approaches JOURNAL OF PHYSICAL CHEMISTRY A 107, 9679-9687 (2003). Export BibTeX
- P. Romaniello, F Lelj Limits in the second-order response of [M(H(2)imXdt) (H(2)imYdt)] neutral complexes (M = Ni, Pd, Pt; H(2)imXdt = monoanion of imidazolidine-2-chalcogenone-4,5-dithione; X = O, S, Se; Y = O, S, Se; X not equal Y): a pure theoretical study based on TD-DFT JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM 636, 23-37 (2003). Export BibTeX
- MC Aragoni, M Arca, T Cassano, C Denotti, FA Devillanova, R Frau, F Isaia, F Lelj, Lippolis V, L Nitti, P. Romaniello, R Tommasi, G Verani NIR dyes based on [M(R,R timdt)(2)] metal-dithiolenes: Additivity of M, R, and R contributions to tune the NIR absorption (M = Ni, Pd, Pt; R,R timdt = monoreduced form of disubstituted imidazolidine-2,4,5-trithione) EUROPEAN JOURNAL OF INORGANIC CHEMISTRY 1939-1947 (2003). Export BibTeX
- P. Romaniello, F Lelj Optical non-linear properties of the [MXY] neutral mixed-ligand dithiolenes (M=Ni, Pd, Pt; X=R(2)timdt, dmit, mnt; Y=R(2)timdt, dmit, mnt; X=AY). The role of coordinated metal, substituents and of high lying excited states CHEMICAL PHYSICS LETTERS 372, 51-58 (2003). Export BibTeX
- T Cassano, R Tommasi, L Nitti, MC Aragoni, M Arca, C Denotti, FA Devillanova, F Isaia, Lippolis V, F Lelj, P. Romaniello Picosecond absorption saturation dynamics in neutral [M(R,R timdt)(2)] metal-dithiolenes JOURNAL OF CHEMICAL PHYSICS 118, 5995-6002 (2003). Export BibTeX
2002
- P. Romaniello, F Lelj Halogen bond in (CH3)(n)X (X = N, P, n = 3; X = S, n = 2) and (CH3)(n)XO (X = N, P, n = 3; X = S, n = 2) adducts with CF3I. Structural and energy analysis including relativistic zero-order regular approximation approach in a density functional theory fram JOURNAL OF PHYSICAL CHEMISTRY A 106, 9114-9119 (2002). Export BibTeX