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Computational analysis to study the effect of infusion of Tetracyanoquinodimethane in zinc based metal-organic framework

The present study reports the computational analysis of band structures and density of state (DOS) profiles of a Tetracyanoquinodimethane (TCNQ) infused IRMOF-1 (Iso Reticular Metal-Organic Framework-1). IRMOF-1 is a zinc-based MOF and has been reported useful in literature for a variety of applicat...

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Autori principali: Virendra Kumar, Harmeet Kaur, K Tankeshwar, Akash Deep
Natura: Artigo
Lingua:Inglês
Pubblicazione: IOP Publishing 2019-01-01
Serie:Materials Research Express
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Accesso online:https://doi.org/10.1088/2053-1591/ab52d5
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