This study focuses on xenon and its interaction with materials of the MOF family. The interatomic interactions were modeled using Lennard-Jones potentials. The MOF atoms are described using the UFF forcefield, whereas the Lennard-Jones parameters of xenon, taken from Ref. 36, are 𝜀 Xe = 221.0 K and 𝜎 Xe = 4.100 Å. To determine cross interaction parameters between xenon and all MOF atoms, we used the Lorentz-Berthelot combination rules. No Coulombic interactions are considered in this force field.