Concepedia

Tuning the electronic, magnetic, and sensing properties of a single atom embedded microporous C<sub>3</sub>N<sub>6</sub> monolayer towards XO<sub>2</sub> (X = C, N, S) gases

Swapnil Deshpande, Mrinalini D. Deshpande, Rajeev Ahuja, Tanveer Hussain

New Journal of Chemistry · 2022 · 14 citations · 54 references

DOI

Concepts

Abstract

2D carbon nitride frameworks have received a lot of attention due to their high potential in many applications, such as gas sensing.

References

54

Generalized Gradient Approximation Made Simple

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, , +16

Electric Field Effect in Atomically Thin Carbon Films

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<i>Ab initio</i>molecular dynamics for liquid metals

Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1993 · 44.9K citations

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The rise of graphene

A. K. Geǐm, Kostya S. Novoselov · Nature Materials · 2007 · 39.5K citations

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Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction

Stefan Grimme · Journal of Computational Chemistry · 2006 · 30.8K citations

, , +17