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To be selected as sorbents for gas storage, metal–organic frameworks (MOFs) must be stable to avoid collapsed in humid media. MIL-88 series (abbreviated as MIL-88s) including MIL-88A, B, C, D satisfies high flexibility and stability; it, therefore, may become a suitable candidate for hydrogen storage based on the adsorption. In this work, the grand canonical Monte Carlo simulations for the pressures...
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