Data for: Adsorption of phenanthroline and its derivatives on Au (111) surface - Influence of substitution on structure and electronic properties
Published: 11 May 2020| Version 1 | DOI: 10.17632/f8yn6zvjc9.1
Contributor:
K. Senthilkumar
Description
These are OUTCAR files of VASP runned optimisations that carry information of coordinates, methodology of systems discussed in the article.
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Categories
Density Functional Theory