DFT study of the structural, optical and electronic properties of platinum doped graphene
Published: 8 July 2020| Version 1 | DOI: 10.17632/5v43y689z9.1
Contributors:
Dipak Sinha, , , Description
This database contains the input, output and chk files generated using GUI Gaussview and calculations performed using Gaussian 09 software. The work in the manuscript titled "DFT study of the structural, optical and electronic properties of platinum doped graphene" can be reproduced using the following input files and performing DFT calculations.The equations and other calculations employed in the study are described in the said manuscript.
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Categories
Graphene, Density Functional Theory, Density of States