Tuning of the gold work function by carborane films studied using Density Functional Theory

Phys. Chem. Chem. Phys., 2019, Accepted Manuscript DOI: 10.1039/C9CP00346K, PaperMartin Hladik, Aliaksei Vetushka, Anton ín Fejfar, Hector Vazquez Using Density Functional Theory including van der Waals interactions, we calculate the adsorption and electronic properties of dithiol-dicarba-closo-dodecaboranes chemisorbed on Au(111) surfaces. Carborane molecules consist of a cage-like structure made... The content of this RSS Feed (c) The Royal Society of Chemistry

Source: RSC - Phys. Chem. Chem. Phys. latest articles - February 22, 2019 Category: Chemistry Authors: Martin Hladik Source Type: research