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Origins of contrasting copper coordination geometries in crystalline copper sulfate pentahydrate

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Phys. Chem. Chem. Phys., 2015, 17,31023-31029
DOI: 10.1039/C5CP05554G, Paper
Michael T. Ruggiero, Alessandro Erba, Roberto Orlando, Timothy M. Korter
Crystal orbital overlap population and crystal orbital Hamiltonian population analyses provide insight into the differing water coordination geometries found in crystalline copper(II) sulfate pentahydrate.
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