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Properties of IRMOF-14 and its analogues M-IRMOF-14 (M = Cd, alkaline earth metals): electronic structure, structural stability, chemical bonding, and optical properties

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a
Center of Theoretical and Computational Chemistry, Department of Chemistry, University of Oslo, P.O. Box 1033 Blindern, N-0315 Oslo, Norway
E-mail: mats.tilset@kjemi.uio.no, l.m.yang@kjemi.uio.no;
Fax: +47 22855441
b
Center for Materials Science and Nanotechnology, Department of Chemistry, University of Oslo, P.O. Box 1033 Blindern, N-0315 Oslo, Norway
Phys. Chem. Chem. Phys., 2012,14, 4713-4723

DOI: 10.1039/C2CP24091B
Received 22 Dec 2011, Accepted 03 Feb 2012
First published online 01 Mar 2012
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