Adding multiple adsorbates on a slab

pymatgen
1

I’m sorry I’m very new to pymatgen. I’m trying to do a coverage study on a surface and I’m wondering how can you add multiple atoms on a slab from AdsorbateSiteFinder. If someone could post a short snippet of their code, I would really appreciate it. Thank you.

2

Hi corbis0216, please let me know if you find the the way to add multiple adsorbates on slabs.

Thanks.

3

Hello, I am also having the same issue.
how can we customize the pymatgen.analysis.adsorption module?
Thanks
Marco

4

It’s actually pretty easy to do, just simply loop the command ads_structures=asf.add_adsorbate(molecule,car_coords) with different moleculer and car_coords.