Double-well potential energy surface in the interaction between h-BN and Ni(111)

Phys. Chem. Chem. Phys., 2019, Accepted Manuscript DOI: 10.1039/C8CP07880G, PaperJorge Ontaneda, Francesc Vi ñes, Francesc Illas, Ricardo Grau-Crespo Density functional theory calculations with non-local correlation functionals, properly accounting for dispersion forces, predict the presence of two minima in the interaction energy between h-BN and Ni(111). These can be... The content of this RSS Feed (c) The Royal Society of Chemistry

Source: RSC - Phys. Chem. Chem. Phys. latest articles - March 13, 2019 Category: Chemistry Authors: Jorge Ontaneda Source Type: research