Mechanical Response of Buckled Germanene: Influence of Temperature, Strain Rate and Point Defects
DOI:
https://doi.org/10.38032/scse.2026.4.167Keywords:
Germanene, Mechanical properties, NEMS, AnisotropyAbstract
Germanene, a two-dimensional material with a unique buckled honeycomb structure, has recently drawn attention for its potential in nanoelectromechanical systems (NEMS) and advanced nano-devices. In this work, we explore how temperature, strain rate, and point defects influence its mechanical performance through molecular dynamics simulations. The findings show that as temperature rises, the fracture stress, strain, and elastic modulus drop sharply by as much as 66% due to stronger atomic vibrations and thermal softening. In contrast, faster strain rates significantly improve these properties, enhancing strength by nearly 45% because atoms have less time to relax. The presence of point vacancies, even in small amounts, weakens the structure considerably, as these defects act as stress concentrators that trigger early fracture. Interestingly, a clear anisotropy is observed: the zigzag direction offers higher strength, while the armchair direction remains more flexible. Overall, the study provides valuable insights into how germanene responds under different conditions and highlights its promise as a durable and tunable material for next-generation nanoelectronic and electromechanical devices.
Downloads
Downloads
Downloads
References
[1] P. F. Ferrari, S. Kim, and A. M. Van Der Zande, ‘Nanoelectromechanical systems from two-dimensional materials’, Appl. Phys. Rev., vol. 10, no. 3, p. 031302, Sept. 2023 DOI: https://doi.org/10.1063/5.0106731
[2] A. Hayat et al., ‘Recent advances, properties, fabrication and opportunities in two-dimensional materials for their potential sustainable applications’, Energy Storage Mater., vol. 59, p. 102780, May 2023. DOI: https://doi.org/10.1016/j.ensm.2023.102780
[3] S. Nigar, Z. Zhou, H. Wang, and M. Imtiaz, ‘Modulating the electronic and magnetic properties of graphene’, RSC Adv., vol. 7, no. 81, pp. 51546–51580, 2017. DOI: https://doi.org/10.1039/C7RA08917A
[4] A. S. M. J. Islam, M. S. Islam, N. Ferdous, J. Park, A. G. Bhuiyan, and A. Hashimoto, ‘Anisotropic mechanical behavior of two dimensional silicon carbide: effect of temperature and vacancy defects’, Mater. Res. Express, vol. 6, no. 12, p. 125073, Dec. 2019. DOI: https://doi.org/10.1088/2053-1591/ab5a96
[5] Md. H. Rahman, E. H. Chowdhury, D. A. Redwan, and S. Hong, ‘Computational characterization of thermal and mechanical properties of single and bilayer germanene nanoribbon’, Comput. Mater. Sci., vol. 190, p. 110272, Apr. 2021. DOI: https://doi.org/10.1016/j.commatsci.2020.110272
[6] R. Chegel and S. Behzad, ‘Tunable Electronic, Optical, and Thermal Properties of two- dimensional Germanene via an external electric field’, Sci. Rep., vol. 10, no. 1, p. 704, Jan. 2020. DOI: https://doi.org/10.1038/s41598-020-57558-x
[7] Q. Pang, Y. Zhang, J.-M. Zhang, V. Ji, and K.-W. Xu, ‘Electronic and magnetic properties of pristine and chemically functionalized germanene nanoribbons’, Nanoscale, vol. 3, no. 10, p. 4330, 2011. DOI: https://doi.org/10.1039/c1nr10594a
[8] A. S. M. J. Islam, Md. S. Akbar, Md. S. Islam, and J. Park, ‘Temperature- and Defect-Induced Uniaxial Tensile Mechanical Behaviors and the Fracture Mechanism of Two-Dimensional Silicon Germanide’, ACS Omega, vol. 6, no. 34, pp. 21861–21871, Aug. 2021. DOI: https://doi.org/10.1021/acsomega.1c01691
Z. D. Sha, C. H. Chiu, Q. X. Pei, and Y. W. Zhang, ‘Effects of grain size, temperature and strain rate on the mechanical properties of polycrystalline graphene – A molecular dynamics study’, Carbon, vol. 85, pp. 135–146, Apr. 2015. DOI: https://doi.org/10.1016/j.carbon.2014.12.092
[10] Md. M. Hassan, J. Islam, W. R. Sajal, Md. N. H. Noman, and Md. A. Rahman, ‘Atomistic simulation of the mechanical behaviors of the pristine and vacancy-induced Ti2C MXene: Effect of temperature, strain rate, and chirality’, Heliyon, vol. 10, no. 4, p. e25913, Feb. 2024. DOI: https://doi.org/10.1016/j.heliyon.2024.e25913
[11] S. J. Mahdizadeh and G. Akhlamadi, ‘Optimized Tersoff empirical potential for germanene’, J. Mol. Graph. Model., vol. 72, pp. 1–5, Mar. 2017. DOI: https://doi.org/10.1016/j.jmgm.2016.11.009
[12] S. Liu, K. Chen, Q. Wu, Y. Gao, C. Xue, and X. Dong, ‘Ulothrix-Derived Sulfur-Doped Porous Carbon for High-Performance Symmetric Supercapacitors’, ACS Omega, vol. 7, no. 12, pp. 10137–10143, Mar. 2022. DOI: https://doi.org/10.1021/acsomega.1c06253
[13] S. Plimpton, ‘Fast Parallel Algorithms for Short-Range Molecular Dynamics’, J. Comput. Phys., vol. 117, no. 1, pp. 1–19, Mar. 1995. DOI: https://doi.org/10.1006/jcph.1995.1039
Published
Conference Proceedings Volume
Section
License
Copyright (c) 2026 Md. Riad Mostafa Mahfuz , Arman Hossain (Author)

This work is licensed under a Creative Commons Attribution 4.0 International License.
All the articles published by this journal are licensed under a Creative Commons Attribution 4.0 International License
