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Predictive modeling of conductivity for carbon black nanocomposites: influence of filler features, interfacial effects and network portion
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  • Published: 02 February 2026

Predictive modeling of conductivity for carbon black nanocomposites: influence of filler features, interfacial effects and network portion

  • Mohammad Boomhendi1,
  • Mostafa Vatani1,
  • Yasser Zare2,
  • Muhammad Tajammal Munir3,
  • Jin-Hwan Choi4 &
  • …
  • Kyong Yop Rhee4 

Scientific Reports , Article number:  (2026) Cite this article

We are providing an unedited version of this manuscript to give early access to its findings. Before final publication, the manuscript will undergo further editing. Please note there may be errors present which affect the content, and all legal disclaimers apply.

Subjects

  • Engineering
  • Materials science
  • Physics

Abstract

The conductivity of carbon black samples depends on more than one or two obvious variables; it arises from a complex interaction of structural and surface factors acting in concert. Considering these interdependencies in a model is essential for designing materials that achieve reliable performance. In this study, we developed a theoretical framework that integrates the filler geometry, interphase thickness, tunneling resistance, tunneling distance, tunneling diameter, percolation threshold, and intrinsic conductivity of the filler. Rather than considering these parameters in isolation, the model allows them to interact, and its predictions are validated using experimental datasets. When the carbon black radius drops to 10 nm and the networked fraction of nanoparticles is 1, the conductivity of the composite increases to 1 S/m. As the particle radius increases or the fraction of networks decreases, the conductivity of the system decreases sharply and, in some cases, returns to the insulating state. The results further show that the composite conductivity is strongly governed by the polymer tunneling resistivity (p) and the interphase conductivity (σint). The lowest σint (< 200 S/m) produces an insulated system, while the composite conductivity maximizes to 3 S/m at p = 10 Ω.m and σint = 8000 S/m. Accordingly, more interphase conduction and less polymer tunnel resistivity are desirable to improve the conductivity of samples.

Data availability

The data that support the findings of this study are available on request.

Abbreviations

σc :

The effective conductivity of the nanocomposite

σmatrix :

Intrinsic electrical conductivity of the polymer matrix

σeff :

Effective conductivity of the filler network

ϕeff :

Effective filler volume fraction

ξ:

Fraction of percolated

η:

Waviness of the conductive pathways

H:

Geometric influence of filler morphology

R:

Radius of carbon black

d:

Particle diameter

σz :

Baseline longitudinal conductivity of the matrix–interphase pathway

t:

Interphase thickness

σf :

Intrinsic conductivity of the filler

σint :

Interphase conductivity

δa :

Tunneling distance

Dt :

Tunneling diameter

p:

Polymer tunneling resistivity

w:

Weight fraction of carbon black in the nanocomposite

ρf :

Filler density

ρp :

Polymer density

γp :

Polymer surface tension

γf :

Filler surface tension

γpf :

Polymer–filler interfacial tension

ϕp :

Percolation threshold

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Funding

No funding was received.

Author information

Authors and Affiliations

  1. Department of Chemical Engineering, Faculty of Engineering, University of Kashan, P.O. Box 87317-53153, Kashan, Iran

    Mohammad Boomhendi & Mostafa Vatani

  2. Biomaterials and Tissue Engineering Research Group, Department of Interdisciplinary Technologies, Breast Cancer Research Center, Motamed Cancer Institute, ACECR, Tehran, Iran

    Yasser Zare

  3. College of Engineering and Technology, American University of the Middle East, Egaila, 54200, Kuwait

    Muhammad Tajammal Munir

  4. Department of Mechanical Engineering, College of Engineering, Kyung Hee University, Yongin, Republic of Korea

    Jin-Hwan Choi & Kyong Yop Rhee

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Contributions

**Mohammad Boomhendi: ** Formal analysis; Investigation; Methodology; Roles/Writing - original draft.**Mostafa Vatani: ** Formal analysis; Methodology; Visualization; Roles/Writing - original draft.**Yasser Zare** : Conceptualization; Formal analysis; Investigation; Methodology; Visualization; Supervision; Roles/Writing - original draft.**Muhammad Tajammal Munir: ** Software; Validation; Writing - review & editing.**Jin-Hwan Choi** : Supervision; Visualization; Validation; Writing - review & editing.**Kyong Yop Rhee: ** Project administration; Supervision; Validation; Writing - review & editing.

Corresponding authors

Correspondence to Yasser Zare, Jin-Hwan Choi or Kyong Yop Rhee.

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Boomhendi, M., Vatani, M., Zare, Y. et al. Predictive modeling of conductivity for carbon black nanocomposites: influence of filler features, interfacial effects and network portion. Sci Rep (2026). https://doi.org/10.1038/s41598-026-38296-y

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  • Received: 29 November 2025

  • Accepted: 29 January 2026

  • Published: 02 February 2026

  • DOI: https://doi.org/10.1038/s41598-026-38296-y

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Keywords

  • Interphase thickness
  • Carbon black
  • Tunneling size
  • Polymer nanocomposites
  • Percolation threshold
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