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)
Berger, J. A., de Boeij, P. L., & van Leeuwen, R. . (2005). A physical model for the longitudinal polarizabilities of polymer chains. JOURNAL OF CHEMICAL PHYSICS, 123. (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)
van Faassen, M. ., de Boeij, P. L., van Leeuwen, R. ., Berger, J. A., & Snijders, J. . (2002). Ultranonlocality in time-dependent current-density-functional theory: Application to conjugated polymers. PHYSICAL REVIEW LETTERS, 88. (Original work published)
Holzmann, M. ., Bernu, B. ., , Martin, R. M., & Ceperley, D. M. (2009). Renormalization factor and e ffective mass of the two-dimensional electron gas. Phys. Rev. B. (Original work published 2009)
Berger, J. A., de Boeij, P. L., & van Leeuwen, R. . (2007). Analysis of the Vignale-Kohn current functional in the calculation of the optical spectra of semiconductors. PHYSICAL REVIEW B, 75. (Original work published 2025)
Briois, V. ., Giorgetti, C. ., Baudelet, F. ., Blanchandin, S. ., Tokumoto, M. S., Pulcinelli, S. H., & Santilli, C. V. (2007). Dynamical study of ZnO nanocrystal and Zn-HDS layered basic zinc acetate formation from sol-gel route. JOURNAL OF PHYSICAL CHEMISTRY C, 111, 3253-3258. https://doi.org/10.1021/jp0662909 (Original work published)
Romaniello, P. ., & de Boeij, P. L. (2007). Relativistic two-component formulation of time-dependent current-density functional theory: Application to the linear response of solids. JOURNAL OF CHEMICAL PHYSICS, 127. (Original work published)
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 2025)
Rödl, C. ., & Schleife, A. . (2013). Photoemission spectra and effective masses of n- and p-type oxide semiconductors from first principles: ZnO, CdO, SnO2, MnO, and NiO. Physica Status Solidi (a). https://doi.org/10.1002/pssa.201330181