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# README for the entry files
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We provide here instructions on how explore the files for this Materials Cloud entry. The data concerns the BSE calculation on 
hydrogenated graphene prototypes, as compared with experimental realization of hydrogenated nanoporous graphene. 

The "optical_gaps.json" file summarizes the BSE optical gaps and GW band gaps, as obtained in the simulations.
In this way it is possible to compute the binding energy for the lowest exciton. 


In this version of the entry, we provide BSE outputs for the final converged calculations, used to compute the optical spectra for all the h-graphene candidates. We structured the folder with respect to the studied system:

- 2side_H-Gr: double side hydrogenated, single layer graphene
- 2sideH-bGr_R_hex
- 2sideH-bGr_TAB_hex

    
## Structures:

We provide also the structures that we studied, within the xsf_prototypes.tar.gz file, in the xsf format.