Hello,
I took the cif file of MOF-200 and MOF-177 from RASPA which I then doped with transition metals using Gausvew and Avogadro to increase the interactions during adsorption of the hydrogen. But I can't simulate the adsorption of hydrogen by the cif file of doped MOF / how to do it please.
Hello, I took the cif file of MOF-200 and MOF-177 from RASPA which I then doped with transition metals using Gausvew and Avogadro to increase the interactions during adsorption of the hydrogen. But I can't simulate the adsorption of hydrogen by the cif file of doped MOF / how to do it please.