IRMOF-10
National Institutes of Health
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We report the development of a forcefield capable of reproducing accurate lattice dynamics of metal-organic frameworks. Phonon…
The adsorption of ammonia in four metal-organic frameworks modified with different functional groups (-OH, -C=O, -Cl, -COOH) was…
The equilibrium solid-state structure, electronic structure, formation enthalpy, chemical bonding, and optical properties of…