Romaniello, P. ., D\textquoterightAndria, M. C., & Lelj, F. . (2010). Nonlinear Optical Properties of Ni(Me6pzS2)MX (M = Ni, Pd, Pt; X = Me2timdt, mnt). The Journal of Physical Chemistry A, 114, 5838-5845. https://doi.org/10.1021/jp911353n
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Romaniello, P. ., Lelj, F. ., Arca, M. ., & Devillanova, F. . (2007). 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. (Original work published 2024)
Romaniello, P. ., & Lelj, F. . (2004). Effects of fluorine atoms on the optical nonlinear response of stilbene derivatives. JOURNAL OF FLUORINE CHEMISTRY, 125, 145-149. (Original work published)
Romaniello, P. ., Aragoni, M. ., Arca, M. ., Cassano, T. ., Denotti, C. ., Devillanova, F. ., … Tommasi, R. . (2003). 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. (Original work published)
Romaniello, P. ., & Lelj, F. . (2003). 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. (Original work published)
Aragoni, M. ., Arca, M. ., Cassano, T. ., Denotti, C. ., Devillanova, F. ., Frau, R. ., … Verani, G. . (2003). 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. (Original work published 2024)
Romaniello, P. ., & Lelj, F. . (2003). 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. (Original work published)
Cassano, T. ., Tommasi, R. ., Nitti, L. ., Aragoni, M. ., Arca, M. ., Denotti, C. ., … Romaniello, P. . (2003). Picosecond absorption saturation dynamics in neutral [M(R,R timdt)(2)] metal-dithiolenes. JOURNAL OF CHEMICAL PHYSICS, 118, 5995-6002. (Original work published)
Romaniello, P. ., & Lelj, F. . (2002). 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. (Original work published)