Methane activation by chromium oxide cations in the gas phase: A theoretical study. - Ivan Rivalta; Nino Russo; Emilia Sicilia (J. Comput. Chem., 2006)

Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table. - Francesco Aquilante; Jochen Autschbach; Rebecca K. Carlson; Liviu F. Chibotaru; Mickaël G. Delcey; Luca De Vico; Ignacio Fdez. Galván; Nicolas Ferré; Luis Manuel Frutos; Laura Gagliardi; Marco Garavelli; Angelo Giussani; et al. (J. Comput. Chem., 2016)

Singular Interface Dynamics of the SARS-CoV-2 Delta Variant Explained with Contact Perturbation Analysis. - Aria Gheeraert; Laurent Vuillon; Laurent Chaloin; Olivier Moncorgé; Thibaut Very; Serge Perez; Vincent Leroux; Isaure Chauvot de Beauchêne; Dominique Mias-Lucquin; Marie-Dominique Devignes; Ivan Rivalta; Bernard Maigret (J. Chem. Inf. Model., 2022)

Modeling solvent effects and convergence of 31P-NMR shielding calculations with COBRAMM. - Francesco Calcagno; Boris Maryasin; Marco Garavelli; Davide Avagliano; Ivan Rivalta (J. Comput. Chem., 2024)