Periodic Hybrid DFT Approach (Including Dispersion) to MgCl2-Supported Ziegler–Natta Catalysts. 2. Model Electron Donor Adsorption on MgCl2 Crystal Surfaces

The Journal of Physical Chemistry C

DOI: 10.1021/jp406977h

Fabio Capone, Luca Rongo, Maddalena D’Amore, Peter H. M. Budzelaar and Vincenzo Busico

Click for full article