Interplay of Superconductivity, Ferromagnetism, and Half-Metallicity in Gated Single-Layer g‑C3N4
Pietro Nicolò Brangi, Francesca Martini, Pierluigi Cudazzo, Matteo Calandra

TL;DR
This paper explores how doping a carbon nitride material can lead to unique electronic states like superconductivity and magnetism.
Contribution
The study reveals a novel platform for strongly correlated states in gated 2D systems with lone pairs.
Findings
Field-effect hole doping in g-C3N4 depletes lone pairs and unveils correlated states.
Superconducting, half-metallic, and ferromagnetic phases coexist in the material.
These effects occur without transition metal ions and at low charging levels.
Abstract
Graphitic carbon nitride (g-C3N4) hosts lone pairs arising from broken carbon–nitrogen bonds in its heptazine structure. These strongly localized and weakly hybridized states form ultraflat bands, potentially leading to correlated states when doped. Using first-principles calculations, we show that field-effect hole doping in single-layer g-C3N4 depletes these lone pairs, unveiling a rich phase diagram with a complex interplay of superconducting, half-metallic, and insulating ferromagnetic phases, even at very low charging and in the absence of transition metal ions. Our work highlights gated two-dimensional systems hosting lone pairs as a novel platform for strongly correlated states.
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Taxonomy
TopicsInorganic Chemistry and Materials · 2D Materials and Applications · MXene and MAX Phase Materials
