Solvation effects on reaction profiles by the polarizable continuum model coupled with the Gaussian density functional method. - Tzonka Mineva; Nino Russo; Emilia Sicilia (J. Comput. Chem., 1998)

On the interaction of Mo and Mo2 with NH3, C2H4, and C3H6 . - Corinne Lacaze-Dufaure; Tzonka Mineva; Nino Russo (J. Comput. Chem., 2001)

Interaction of Hydrogen with Au Modified by Pd and Rh in View of Electrochemical Applications. - Fernanda Juarez; German Soldano; Elizabeth Santos; Hazar Guesmi; Frederik J. Tielens; Tzonka Mineva (Comput., 2016)

Regression Machine Learning Models Used to Predict DFT-Computed NMR Parameters of Zeolites. - Robin Gaumard; Dominik Dragún; Jesús N. Pedroza-Montero; Bruno Alonso; Hazar Guesmi; Irina Malkin Ondík; Tzonka Mineva (Comput., 2022)