Adsorption of phenanthroline and its derivatives on Au (111) surface - Influence of substitution on structure and electronic properties
Published: 23 March 2020| Version 1 | DOI: 10.17632/7x26dr49pb.1
Presented data includes output files corresponding to structure optimisation of the systems dealt in the article. Refer the articles to understand the nomenclature and configuration.
Bharathiar University School of Physical Sciences
Density Functional Theory