Periodic DFT Study of the Tetragonal ZrO2 Nanocrystals: Equilibrium Morphology Modeling and Atomistic Surface Hydration Thermodynamics

W. Piskorz, J. Gryboś, F. Zasada, P. Zapała,S. Cristol, J.-F. Paul, Z.Sojka, J. Phys. Chem. C 116, 19307 (2012).