Simulating the Hydration Structure of Low- and High-Spin [Fe(bpy)3]2+: Long-Range Dispersion and Many-Body Effects
When characterizing transition metal complexes and their functionalities, the {importance|significance|value} of {including|such as|which includes|like} the solvent as an active participant in {both|each} theoretical and experimental models is {being|becoming|getting} realized {more|much…