Vibrational Analysis of Paraelectric-Ferroelectric Transition of LiNbO3: An Ab-Initio Quantum Mechanical Treatment. - Francesco Silvio Gentile; Rosita Diana; Barbara Panunzi; Ugo Caruso; Alexander Platonenko; Fabien Pascale; Roberto Dovesi (Symmetry, 2021)

Theoretical investigation of hydroxylated analogues of valinomycin as potassium transporter. - Lucia Sessa; Simona Concilio; Francesco Marrafino; Arkadeep Sarkar; Rosita Diana; Stefano Piotto (Comput. Biol. Chem., 2023)