Electronic properties of heterometallic zeolitic imidazolate framework and its encapsulation with Ni, Pd and Pt
The electronic properties of heterometallic zeolitic imidazolate frameworks (ZIF-8) containing Cd and Zn metal centres have been examined using density functional theory to reveal the nature of metal to ligand interaction, band gap, density of states and charge distribution. The band gap energy of m...
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| Format: | Article |
| Language: | English |
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Elsevier B.V.
2022
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| Online Access: | https://repository.ugm.ac.id/278811/1/Pambudi_MIPA.pdf |