Ideal strength and emergent superconductivity in a three-dimensional sp<sup>2</sup>-carbon network cT16

The design of carbon allotropes that simultaneously exhibit mechanical robustness and quantum functionalities remains a longstanding challenge. Here, we report a comprehensive first-principles study of cT16, a three-dimensional sp<sup>2</sup>-hybridized carbon network with topologically interlinked graphene-like sheets. The structure features high ideal tensile and shear strengths, with pronounced anisotropy arising from strain-induced bond rehybridization and interlayer slipping mechanisms. Electronic structure calculations reveal that cT16 is intrinsically metallic, with dispersive π-bands crossing the Fermi level. Phonon dispersion confirms its dynamical stability, and analysis of the Eliashberg spectral function yields a moderate electron-phonon coupling constant (<i>λ</i> = 0.481) and a logarithmic average frequency of 696.2 K. The superconducting transition temperature is estimated to reach 7.2 K at <i>via</i> the Allen-Dynes formula, without requiring any external doping or intercalation. Compared to existing carbon superconductors such as CaC<sub>6</sub> or boron-doped diamond, cT16 uniquely combines chemical purity, structural resilience, and intrinsic superconductivity. These findings position cT16 as a promising lightweight carbon superconductor and expand the functional landscape of three-dimensional sp<sup>2</sup>-carbon frameworks.

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Publication Details

Journal
Physical Chemistry Chemical Physics
Published
2025-01-01
DOI
https://doi.org/10.1039/d5cp03051j
Citations
1
Primary Topic
Boron and Carbon Nanomaterials Research
Type
article
Field-Weighted Citation Impact
0.52
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Ideal strength and emergent superconductivity in a three-dimensional sp2-carbon network cT16

Ying Xu, Hao Chen, Jing Wang, Shan Jiang et al.
1 citations
Physical Chemistry Chemical Physics
Boron and Carbon Nanomaterials Research
0.52
article

Ideal strength and emergent superconductivity in a three-dimensional sp2-carbon network cT16

Ying Xu, Hao Chen, Jing Wang, Shan Jiang, Dan Zhou
article en
1 citations

Abstract

The design of carbon allotropes that simultaneously exhibit mechanical robustness and quantum functionalities remains a longstanding challenge. Here, we report a comprehensive first-principles study of cT16, a three-dimensional sp<sup>2</sup>-hybridized carbon network with topologically interlinked graphene-like sheets. The structure features high ideal tensile and shear strengths, with pronounced anisotropy arising from strain-induced bond rehybridization and interlayer slipping mechanisms. Electronic structure calculations reveal that cT16 is intrinsically metallic, with dispersive π-bands crossing the Fermi level. Phonon dispersion confirms its dynamical stability, and analysis of the Eliashberg spectral function yields a moderate electron-phonon coupling constant (<i>λ</i> = 0.481) and a logarithmic average frequency of 696.2 K. The superconducting transition temperature is estimated to reach 7.2 K at <i>via</i> the Allen-Dynes formula, without requiring any external doping or intercalation. Compared to existing carbon superconductors such as CaC<sub>6</sub> or boron-doped diamond, cT16 uniquely combines chemical purity, structural resilience, and intrinsic superconductivity. These findings position cT16 as a promising lightweight carbon superconductor and expand the functional landscape of three-dimensional sp<sup>2</sup>-carbon frameworks.

Physical Chemistry Chemical PhysicsVol. 27(37)
Changchun University of Science and Technology (CN), Changchun University (CN)
Openalex Percentile: Top 34%
Boron and Carbon Nanomaterials Research
0.52
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Ideal strength and emergent superconductivity in a three-dimensional sp<sup>2</sup>-carbon network cT16 — Ying Xu, Hao Chen, et al. · Physical Chemistry Chemical Physics (2025) | TGRS Research Map | TGRS