The required level of isosteric heat for the adsorptive/storage delivery of H2 in the UiO series of MOFs†
Abstract
The required level of isosteric heat of adsorption for efficient storage and delivery of H2 in the UiO series of MOFs was theoretically predicted using molecular simulations. Very high isosteric heats may lead to enhanced storage capacities, however the real H2 delivery capacity is practically reduced. In this respect, for maximum H2 delivery, there exists an optimum isosteric heat value (28–29 kJ mol−1).