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Pit Sippel, Dmytro Denysenko, Alois Loidl, Peter Lunkenheimer, German Sastre and Dirk Volkmer Dielectric Relaxation Processes, Electronic Structure, and Band Gap Engineering of MFU-4-type Metal-Organic Frameworks: Towards a Rational Design of Semiconducting Microporous Materials Advanced Functional Materials 24

Version of Record online: 18 MAR 2014 | DOI: 10.1002/adfm.201400083

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Electrical properties of MFU-4 and Co-MFU-4 metal-organic frameworks are investigated by temperature-dependent broad-band dielectric and optical spectroscopy. Density functional theory calculations performed for framework and cluster model compounds give a detailed picture of the frameworks' electronic structures and confirm experimental band gap values. The combined results enable a systematic engineering of MFU-4-type semiconducting microporous materials.

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