Reuse & Permissions

It is not necessary to obtain permission to reuse this article or its components as it is available under the terms of the Creative Commons Attribution 4.0 International license. This license permits unrestricted use, distribution, and reproduction in any medium, provided attribution to the author(s) and the published article's title, journal citation, and DOI are maintained. Please note that some figures may have been included with permission from other third parties. It is your responsibility to obtain the proper permission from the rights holder directly for these figures.

Export citation

Export citation

Choose format for download:

Download Citation
  • Open Access

Thermal Transport in a 2D Amorphous Material

Yuxi Wang1,2,*, Nianjie Liang1,2,*, Xingxing Zhang3,*, Wujuan Yan1,2,*, Haiyu He1,2,*, Alfredo Fiorentino4, Xinwei Tao3, Ang Li5, Fuwei Yang6 et al.

Buxuan Li7, Te-Huan Liu8, Jia Zhu9, Wu Zhou5, Wei Wang2,10, Stefano Baroni4, Lin Zhou3,†, and Bai Song1,2,‡

  • *These authors contributed equally to this work.
  • †Contact author: linzhou@sjtu.edu.cn
  • ‡Contact author: songbai@pku.edu.cn

Phys. Rev. X 15, 031077 – Published 26 September, 2025

DOI: https://doi.org/10.1103/fjww-9pm3

Abstract

Two-dimensional (2D) crystals proved revolutionary soon after graphene was discovered in 2004. However, 2D amorphous materials down to a single layer of atoms only became accessible in 2020, and they remain largely unexplored. In particular, the thermophysical properties of amorphous materials are of great interest upon transition from 3D to 2D. Here, we probe and simulate thermal transport in monolayer amorphous carbon (MAC). An ultralow cross-plane thermal conductivity (κ) is measured for van der Waals stacked multilayers, which is comparable to that of randomly stacked graphene despite the extra disorder in MAC. This result reveals the predominant role of the weak interlayer interactions in 2D materials. Meanwhile, an unexpectedly high in-plane κ is obtained for freestanding monolayers, which is a few times higher than what is predicted by conventional wisdom for 3D amorphous carbon with a similar sp2 fraction. This observation is primarily attributed to the dimensionality-induced reduction of anharmonicity and the unique low-frequency out-of-plane vibrational modes in MAC. Amorphous materials at the 2D limit open up new avenues for understanding and manipulating heat at the atomic scale.

View figure in article

Physics Subject Headings (PhySH)

Popular Summary

Article Text

Supplemental Material

References (69)

  1. Physical Properties of Amorphous Materials (Springer Science & Business Media, New York, 1985).
  2. L. Berthier and G. Biroli, Theoretical perspective on the glass transition and amorphous materials, Rev. Mod. Phys. 83, 587 (2011).
  3. M. M. J. Treacy and K. B. Borisenko, The local structure of amorphous silicon, Science 335, 950 (2012).
  4. P. Y. Huang, S. Kurasch, J. S. Alden, A. Shekhawat, A. A. Alemi, P. L. McEuen, J. P. Sethna, U. Kaiser, and D. A. Muller, Imaging atomic rearrangements in two-dimensional silica glass: Watching silica’s dance, Science 342, 224 (2013).
  5. Y. Yang, J. Zhou, F. Zhu, Y. Yuan, D. J. Chang, D. S. Kim, M. Pham, A. Rana, X. Tian, Y. Yao, S. J. Osher, A. K. Schmid, L. Hu, P. Ercius, and J. Miao, Determining the three-dimensional atomic structure of an amorphous solid, Nature (London) 592, 60 (2021).
  6. W. H. Zachariasen, The atomic arrangement in glass, J. Am. Chem. Soc. 54, 3841 (1932).
  7. S. Hong et al., Ultralow-dielectric-constant amorphous boron nitride, Nature (London) 582, 511 (2020).
  8. Y. Shang, Z. Liu, J. Dong, M. Yao, Z. Yang, Q. Li, C. Zhai, F. Shen, X. Hou, L. Wang, N. Zhang, W. Zhang, R. Fu, J. Ji, X. Zhang, H. Lin, Y. Fei, B. Sundqvist, W. Wang, and B. Liu, Ultrahard bulk amorphous carbon from collapsed fullerene, Nature (London) 599, 599 (2021).
  9. L. Isaeva, G. Barbalinardo, D. Donadio, and S. Baroni, Modeling heat transport in crystals and glasses from a unified lattice-dynamical approach, Nat. Commun. 10, 3853 (2019).
  10. M. Simoncelli, N. Marzari, and F. Mauri, Unified theory of thermal transport in crystals and glasses, Nat. Phys. 15, 809 (2019).
  11. V. L. Deringer, N. Bernstein, G. Csányi, C. Ben Mahmoud, M. Ceriotti, M. Wilson, D. A. Drabold, and S. R. Elliott, Origins of structural and electronic transitions in disordered silicon, Nature (London) 589, 59 (2021).
  12. H. Zhao, X. Chen, G. Wang, Y. Qiu, and L. Guo, Two-dimensional amorphous nanomaterials: Synthesis and applications, 2D Mater. 6, 032002 (2019).
  13. K. S. Novoselov, A. K. Geim, S. V. Morozov, D. Jiang, Y. Zhang, S. V. Dubonos, I. V. Grigorieva, and A. A. Firsov, Electric field effect in atomically thin carbon films, Science 306, 666 (2004).
  14. C.-T. Toh, H. Zhang, J. Lin, A. S. Mayorov, Y.-P. Wang, C. M. Orofeo, D. B. Ferry, H. Andersen, N. Kakenov, Z. Guo, I. H. Abidi, H. Sims, K. Suenaga, S. T. Pantelides, and B. Özyilmaz, Synthesis and properties of free-standing monolayer amorphous carbon, Nature (London) 577, 199 (2020).
  15. H. Tian et al., Disorder-tuned conductivity in amorphous monolayer carbon, Nature (London) 615, 56 (2023).
  16. X. Bai, P. Hu, A. Li, Y. Zhang, A. Li, G. Zhang, Y. Xue, T. Jiang, Z. Wang, H. Cui, J. Kang, H. Zhao, L. Gu, W. Zhou, L.-M. Liu, X. Qiu, and L. Guo, Nitrogen-doped amorphous monolayer carbon, Nature (London) 634, 80 (2024).
  17. X. Gu, Y. Wei, X. Yin, B. Li, and R. Yang, Colloquium: Phononic thermal properties of two-dimensional materials, Rev. Mod. Phys. 90, 041002 (2018).
  18. N. Liang, Y. Wang, and B. Song, Disordered hyperuniformity and thermal transport in monolayer amorphous carbon, Sci. China Phys. Mech. Astron. 68, 226111 (2025).
  19. F. Tian et al., Unusual high thermal conductivity in boron arsenide bulk crystals, Science 361, 582 (2018).
  20. X. Qian, J. Zhou, and G. Chen, Phonon-engineered extreme thermal conductivity materials, Nat. Mater. 20, 1188 (2021).
  21. P. B. Allen and J. L. Feldman, Thermal conductivity of disordered harmonic solids, Phys. Rev. B 48, 12581 (1993).
  22. F. DeAngelis, M. G. Muraleedharan, J. Moon, H. R. Seyf, A. J. Minnich, A. J. H. McGaughey, and A. Henry, Thermal transport in disordered materials, Nanoscale Microscale Thermophys. Eng. 23, 81 (2019).
  23. C. J. Morath, H. J. Maris, J. J. Cuomo, D. L. Pappas, A. Grill, V. V. Patel, J. P. Doyle, and K. L. Saenger, Picosecond optical studies of amorphous diamond and diamondlike carbon: Thermal conductivity and longitudinal sound velocity, J. Appl. Phys. 76, 2636 (1994).
  24. A. Giri, C. J. Dionne, and P. E. Hopkins, Atomic coordination dictates vibrational characteristics and thermal conductivity in amorphous carbon, npj Comput. Mater. 8, 55 (2022).
  25. S. E. Kim, F. Mujid, A. Rai, F. Eriksson, J. Suh, P. Poddar, A. Ray, C. Park, E. Fransson, Y. Zhong, D. A. Muller, P. Erhart, D. G. Cahill, and J. Park, Extremely anisotropic van der Waals thermal conductors, Nature (London) 597, 660 (2021).
  26. See Supplemental Material at http://link.aps.org/supplemental/10.1103/fjww-9pm3 for Supplemental Notes 1–14, Figs. S1–S24, and Tables S1–S3, which provide details of the sample preparation, thermal measurements, and atomistic simulations.
  27. D. Estrada, Z. Li, G.-M. Choi, S. N. Dunham, A. Serov, J. Lee, Y. Meng, F. Lian, N. C. Wang, A. Perez, R. T. Haasch, J.-M. Zuo, W. P. King, J. A. Rogers, D. G. Cahill, and E. Pop, Thermal transport in layer-by-layer assembled polycrystalline graphene films, npj 2D Mater. Appl. 3, 10 (2019).
  28. G. A. Slack, Anisotropic thermal conductivity of pyrolytic graphite, Phys. Rev. 127, 694 (1962).
  29. F. Yang, W. Zhou, Z. Zhang, X. Huang, J. Zhang, N. Liang, W. Yan, Y. Wang, M. Ding, Q. Guo, Y. Han, T.-H. Liu, K. Liu, Q. Zheng, and B. Song, Ultrahigh thermal conductance across superlubric interfaces in twisted graphite, Phys. Rev. Lett. 134, 146302 (2025).
  30. S. Mukhopadhyay, D. S. Parker, B. C. Sales, A. A. Puretzky, M. A. McGuire, and L. Lindsay, Two-channel model for ultralow thermal conductivity of crystalline Tl3VSe4, Science 360, 1455 (2018).
  31. Q. D. Gibson, T. Zhao, L. M. Daniels, H. C. Walker, R. Daou, S. Hébert, M. Zanella, M. S. Dyer, J. B. Claridge, B. Slater, M. W. Gaultois, F. Corà, J. Alaria, and M. J. Rosseinsky, Low thermal conductivity in a modular inorganic material with bonding anisotropy and mismatch, Science 373, 1017 (2021).
  32. A. J. Bullen, K. E. O’Hara, D. G. Cahill, O. Monteiro, and A.von Keudell, Thermal conductivity of amorphous carbon thin films, J. Appl. Phys. 88, 6317 (2000).
  33. M. Shamsa, W. L. Liu, A. A. Balandin, C. Casiraghi, W. I. Milne, and A. C. Ferrari, Thermal conductivity of diamond-like carbon films, Appl. Phys. Lett. 89, 161921 (2006).
  34. S. Chen, Q. Wu, C. Mishra, J. Kang, H. Zhang, K. Cho, W. Cai, A. A. Balandin, and R. S. Ruoff, Thermal conductivity of isotopically modified graphene, Nat. Mater. 11, 203 (2012).
  35. R. C. Yu, N. Tea, M. B. Salamon, D. Lorents, and R. Malhotra, Thermal conductivity of single crystal C60, Phys. Rev. Lett. 68, 2050 (1992).
  36. J. R. Olson, K. A. Topp, and R. O. Pohl, Specific heat and thermal conductivity of solid fullerenes, Science 259, 1145 (1993).
  37. L. Wei, P. K. Kuo, R. L. Thomas, T. R. Anthony, and W. F. Banholzer, Thermal conductivity of isotopically modified single crystal diamond, Phys. Rev. Lett. 70, 3764 (1993).
  38. C. N. Hooker, A. R. Ubbelohde, and D. A. Young, Anisotropy of thermal conductance in near-ideal graphite, Proc. Math. Phys. Eng. Sci. 284, 17 (1965).
  39. H. Wang, S. Hu, K. Takahashi, X. Zhang, H. Takamatsu, and J. Chen, Experimental study of thermal rectification in suspended monolayer graphene, Nat. Commun. 8, 15843 (2017).
  40. C. Yu, L. Shi, Z. Yao, D. Li, and A. Majumdar, Thermal conductance and thermopower of an individual single-wall carbon nanotube, Nano Lett. 5, 1842 (2005).
  41. A. Hirsch, The era of carbon allotropes, Nat. Mater. 9, 868 (2010).
  42. O. Hod, E. Meyer, Q. Zheng, and M. Urbakh, Structural superlubricity and ultralow friction across the length scales, Nature (London) 563, 485 (2018).
  43. F. Eriksson, E. Fransson, C. Linderälv, Z. Fan, and P. Erhart, Tuning the through-plane lattice thermal conductivity in van der Waals structures through rotational (dis)ordering, ACS Nano 17, 25565 (2023).
  44. G. Chen, Non-Fourier phonon heat conduction at the microscale and nanoscale, Nat. Rev. Phys. 3, 555 (2021).
  45. S. Ghosh, W. Bao, D. L. Nika, S. Subrina, E. P. Pokatilov, C. N. Lau, and A. A. Balandin, Dimensional crossover of thermal transport in few-layer graphene, Nat. Mater. 9, 555 (2010).
  46. L. Yang, Y. Tao, Y. Zhu, M. Akter, K. Wang, Z. Pan, Y. Zhao, Q. Zhang, Y. Q. Xu, R. Chen, T. T. Xu, Y. Chen, Z. Mao, and D. Li, Observation of superdiffusive phonon transport in aligned atomic chains, Nat. Nanotechnol. 16, 764 (2021).
  47. Y. Wang, Z. Fan, P. Qian, M. A. Caro, and T. Ala-Nissila, Density dependence of thermal conductivity in nanoporous and amorphous carbon with machine-learned molecular dynamics, Phys. Rev. B 111, 094205 (2025).
  48. J. Moon and Z. Tian, Crystal-like thermal transport in amorphous carbon, npj Comput. Mater. 11, 137 (2025).
  49. J. Yang, E. Ziade, C. Maragliano, R. Crowder, X. Wang, M. Stefancich, M. Chiesa, A. K. Swan, and A. J. Schmidt, Thermal conductance imaging of graphene contacts, J. Appl. Phys. 116, 023515 (2014).
  50. A. J. Schmidt, R. Cheaito, and M. Chiesa, A frequency-domain thermoreflectance method for the characterization of thermal properties, Rev. Sci. Instrum. 80, 094901 (2009).
  51. K. Chen et al., Ultrahigh thermal conductivity in isotope-enriched cubic boron nitride, Science 367, 555 (2020).
  52. L. Shi, D. Li, C. Yu, W. Jang, D. Kim, Z. Yao, P. Kim, and A. Majumdar, Measuring thermal and thermoelectric properties of one-dimensional nanostructures using a microfabricated device, J. Heat Transfer 125, 881 (2003).
  53. Y. Wang, R. Lin, P. Zhu, Q. Zheng, Q. Wang, D. Li, and J. Zhu, Cation dynamics governed thermal properties of lead halide perovskite nanowires, Nano Lett. 18, 2772 (2018).
  54. J. Zhuang, R. Zhao, J. Dong, T. Yan, and F. Ding, Evolution of domains and grain boundaries in graphene: A kinetic Monte Carlo simulation, Phys. Chem. Chem. Phys. 18, 2932 (2016).
  55. S. Le Roux and V. Petkov, ISAACS—interactive structure analysis of amorphous and crystalline systems, J. Appl. Crystallogr. 43, 181 (2010).
  56. K. Hermann, Periodic overlayers and moiré patterns: Theoretical studies of geometric properties, J. Phys. Condens. Matter 24, 314210 (2012).
  57. A. Stukowski, Visualization and analysis of atomistic simulation data with ovito–the Open Visualization Tool, Modelling Simul. Mater. Sci. Eng. 18, 015012 (2010).
  58. A. P. Thompson, H. M. Aktulga, R. Berger, D. S. Bolintineanu, W. M. Brown, P. S. Crozier, P. J. in ’t Veld, A. Kohlmeyer, S. G. Moore, T. D. Nguyen, R. Shan, M. J. Stevens, J. Tranchida, C. Trott, and S. J. Plimpton, LAMMPS—a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales, Comput. Phys. Commun. 271, 108171 (2022).
  59. F. Müller-Plathe, A simple nonequilibrium molecular dynamics method for calculating the thermal conductivity, J. Chem. Phys. 106, 6082 (1997).
  60. L. Lindsay and D. A. Broido, Optimized Tersoff and Brenner empirical potential parameters for lattice dynamics and phonon thermal transport in carbon nanotubes and graphene, Phys. Rev. B 81, 205441 (2010).
  61. Y.-T. Zhang, Y.-P. Wang, Y.-Y. Zhang, S. Du, and S. T. Pantelides, Thermal transport of monolayer amorphous carbon and boron nitride, Appl. Phys. Lett. 120, 222201 (2022).
  62. G. C. Loh, E. H. T. Teo, and B. K. Tay, Phonon localization around vacancies in graphene nanoribbons, Diamond Relat. Mater. 23, 88 (2012).
  63. E. Fransson, M. Slabanja, P. Erhart, and G. Wahnström, dynasor—A tool for extracting dynamical structure factors and current correlation functions from molecular dynamics simulations, Adv. Theory Simul. 4, 2000240 (2021).
  64. A. Togo and I. Tanaka, First principles phonon calculations in materials science, Scr. Mater. 108, 1 (2015).
  65. G. Barbalinardo, Z. Chen, N. W. Lundgren, and D. Donadio, Efficient anharmonic lattice dynamics calculations of thermal transport in crystalline and disordered solids, J. Appl. Phys. 128, 135104 (2020).
  66. J. M. Larkin and A. J. H. McGaughey, Thermal conductivity accumulation in amorphous silica and amorphous silicon, Phys. Rev. B 89, 144303 (2014).
  67. Y. Liu, H. Liang, L. Yang, G. Yang, H. Yang, S. Song, Z. Mei, G. Csányi, and B. Cao, Unraveling thermal transport correlated with atomistic structures in amorphous gallium oxide via machine learning combined with experiments, Adv. Mater. 35, 2210873 (2023).
  68. A. Fiorentino, P. Pegolo, and S. Baroni, Hydrodynamic finite-size scaling of the thermal conductivity in glasses, npj Comput. Mater. 9, 157 (2023).
  69. A. Fiorentino, E. Drigo, S. Baroni, and P. Pegolo, Unearthing the foundational role of anharmonicity in heat transport in glasses, Phys. Rev. B 109, 224202 (2024).

Outline

Information

Sign In to Your Journals Account

Filter

Filter

Article Lookup

Enter a citation