Role of oxygen vacancy in the adsorption and dissociation of the water molecule on the surfaces of pure and Ni-doped rutile (110): a periodic full-potential DFT study

Autor: Heydari, Hajar, Elahifard, MohammadReza, Behjatmanesh-Ardakani, Reza
Zdroj: In Surface Science January 2019 679:218-224
Databáze: ScienceDirect