Data for: Adsorption of phenanthroline and its derivatives on Au (111) surface - Influence of substitution on structure and electronic properties

Name: Data for: Adsorption of phenanthroline and its derivatives on Au (111) surface - Influence of substitution on structure and electronic properties
Creator: K. Senthilkumar
Published: 2020-05-11T16:05:18.094Z
Keywords: Density Functional Theory

Senthilkumar, K.

doi:10.17632/f8yn6zvjc9.1

Data for: Adsorption of phenanthroline and its derivatives on Au (111) surface - Influence of substitution on structure and electronic properties

Published: 11-05-2020| 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.

Data for: Adsorption of phenanthroline and its derivatives on Au (111) surface - Influence of substitution on structure and electronic properties

Description

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