Abstract
Ubiquitous oxygen drives degradation, spoilage, and side reactions, making oxygen scavenging essential for materials preservation and reaction stabilization. However, conventional oxygen scavengers exhibit limited oxygen removal rates and capacities far below their theoretical maximums, wasting resources while lagging behind industry needs. Here, we report Fe-based metallic glasses as efficient oxygen scavengers, achieving oxygen removal rates 1–4 orders of magnitude higher than conventional systems. In FeSiB metallic glass, Fe oxidation synergistically activates Si, delivering a 24-hour oxygen removal capacity of 1.439 L g-1—reaching the Fe-based theoretical limit—and a 48-hour capacity of 1.596 L g-1, surpassing it. Density functional theory calculations reveal that the amorphous structure significantly lowers the oxygen adsorption energy barrier and facilitates O–O bond cleavage. Moreover, the generated self-reinforcing microdomains mediate O2/H2O transport via robust autocatalytic cycling. These results highlight a promising strategy for oxygen potential control and suggest a possible paradigm for catalytic applications.
Similar content being viewed by others
Data availability
Source data are provided with this paper (ref. 59). All the raw data relevant to the study are available from the corresponding author upon request.
References
Cooksey, K. Oxygen scavenging packaging systems. In Encyclopedia of Polymer Science and Technology (ed. Kroschwitz, J. I.) (Wiley, 2002) https://doi.org/10.1002/0471440264.pst570.
Close, T., Tulsyan, G., Diaz, C. A., Weinstein, S. J. & Richter, C. Reversible oxygen scavenging at room temperature using electrochemically reduced titanium oxide nanotubes. Nat. Nanotechnol. 10, 418–422 (2015).
Gaikwad, K. K., Singh, S. & Lee, Y. S. Oxygen scavenging films in food packaging. Environ. Chem. Lett. 16, 523–538 (2018).
Ahuja, A. et al. Oxygen scavengers in active food packaging systems. In Smart Food Packaging Systems: Innovations and Technology Applications, 103–129 (eds Mukherjee, A. et al.) (Wiley, 2024).
Rommens, K. T. & Saeys, M. Molecular views on Fischer–Tropsch synthesis. Chem. Rev. 123, 5798–5858 (2023).
Foltynowicz, Z., Bardenshtein, A., Sängerlaub, S., Antvorskov, H. & Kozak, W. Nanoscale, zero valent iron particles for application as oxygen scavenger in food packaging. Food Packag. Shelf Life 11, 74–83 (2017).
Gupta, P. Role of oxygen absorbers in food as packaging material, their characterization and applications. J. Food Sci. Technol. 61, 242–252 (2024).
Dey, A. & Neogi, S. Oxygen scavengers for food packaging applications: a review. Trends Food Sci. Technol. 90, 26–34 (2019).
Cruz, R. S., Camilloto, G. P. & dos Santos Pires, A. C. Oxygen scavengers: an approach on food preservation. Struct. Funct. Food Eng. 2, 21–42 (2012).
Miltz, J. & Perry, M. Evaluation of the performance of iron-based oxygen scavengers, with comments on their optimal applications. Packag. Technol. Sci.: Int. J. 18, 21–27 (2005).
Mu, H. et al. A nanosised oxygen scavenger: preparation and antioxidant application to roasted sunflower seeds and walnuts. Food Chem. 136, 245–250 (2013).
Guo, H. et al. Tensile ductility and necking of metallic glass. Nat. Mater. 6, 735–739 (2007).
Liu, Y. H. et al. Super plastic bulk metallic glasses at room temperature. Science 315, 1385–1388 (2007).
Li, M.-X. et al. High-temperature bulk metallic glasses developed by combinatorial methods. Nature 569, 99–103 (2019).
Zhang, L.-C., Jia, Z., Lyu, F., Liang, S.-X. & Lu, J. A review of catalytic performance of metallic glasses in wastewater treatment: recent progress and prospects. Prog. Mater. Sci. 105, 100576 (2019).
Pan, J., Ivanov, Y. P., Zhou, W. H., Li, Y. & Greer, A. L. Strain-hardening and suppression of shear-banding in rejuvenated bulk metallic glass. Nature 578, 559–562 (2020).
Li, H. X., Lu, Z. C., Wang, S. L., Wu, Y. & Lu, Z. P. Fe-based bulk metallic glasses: glass formation, fabrication, properties and applications. Prog. Mater. Sci. 103, 235–318 (2019).
Nam, S. & Tratnyek, P. G. Reduction of azo dyes with zero-valent iron. Water Res. 34, 1837–1845 (2000).
Choe, S., Chang, Y.-Y., Hwang, K.-Y. & Khim, J. Kinetics of reductive denitrification by nanoscale zero-valent iron. Chemosphere 41, 1307–1311 (2000).
Si, J. et al. Porous composite architecture bestows Fe-based glassy alloy with high and ultra-durable degradation activity in decomposing azo dye. J. Hazard. Mater. 388, 122043 (2020).
Bissette, A. J. & Fletcher, S. P. Mechanisms of autocatalysis. Angew. Chem. Int. Ed. 52, 12800–12826 (2013).
Hanopolskyi, A. I., Smaliak, V. A., Novichkov, A. I. & Semenov, S. N. Autocatalysis: kinetics, mechanisms and design. ChemSystemsChem 3, e2000026 (2021).
Pant, A. F., Sängerlaub, S. & Müller, K. Gallic acid as an oxygen scavenger in bio-based multilayer packaging films. Materials 10, 489 (2017).
Andersson, M., Andersson, T., Adlercreutz, P., Nielsen, T. & Hörnsten, E. G. Toward an enzyme-based oxygen scavenging laminate. Influence of industrial lamination conditions on the performance of glucose oxidase. Biotechnol. Bioeng. 79, 37–42 (2002).
Janjarasskul, T., Min, S. C. & Krochta, J. M. Triggering mechanisms for oxygen-scavenging function of ascorbic acid-incorporated whey protein isolate films. J. Sci. Food Agric. 93, 2939–2944 (2013).
Gaikwad, K. K. & Lee, Y. S. Novel natural phenolic compound-based oxygen scavenging system for active packaging applications. J. Food Meas. Charact. 10, 533–538 (2016).
Gaikwad, K. K. & Lee, Y. S. Effect of storage conditions on the absorption kinetics of non-metallic oxygen scavenger suitable for moist food packaging. J. Food Meas. Charact. 11, 965–971 (2017).
Cynthia, L. & Ebner, A. L. B. Oxygen Scavenger Block Copolymers and Compositions. Patent No. US 7,754,798 B2 (United States Patent, 2010).
Byun, Y., Whiteside, S., Cooksey, K., Darby, D. & Dawson, P. L. α-Tocopherol-loaded polycaprolactone (PCL) nanoparticles as a heat-activated oxygen scavenger. J. Agric. Food Chem. 59, 1428–1431 (2011).
Altieri, C. et al. Use of entrapped microorganisms as biological oxygen scavengers in food packaging applications. LWT-Food Sci. Technol. 37, 9–15 (2004).
Xu, L., Kirvassilis, D., Bai, Y. & Mavrikakis, M. Atomic and molecular adsorption on Fe(110). Surf. Sci. 667, 54–65 (2018).
Zhao, X. et al. Alkaline oxygen reduction/evolution reaction electrocatalysis: a critical review focus on orbital structure, non-noble metal catalysts, and descriptors. Chem. Eng. J. 497, 155005 (2024).
Wang, Y. H. et al. Oxygen defect engineering promotes synergy between adsorbate evolution and single lattice oxygen mechanisms of OER in transition metal-based (oxy) hydroxide. Adv. Sci. 10, 2303321 (2023).
Nørskov, J. K., Abild-Pedersen, F., Studt, F. & Bligaard, T. Density functional theory in surface chemistry and catalysis. Proc. Natl. Acad. Sci. 108, 937–943 (2011).
Hammer, B. & Norskov, J. K. Why gold is the noblest of all the metals. Nature 376, 238–240 (1995).
Hammer, B. & Nørskov, J. K. Electronic factors determining the reactivity of metal surfaces. Surf. Sci. 343, 211–220 (1995).
Hammer, B. & Nørskov, J. K. Theoretical surface science and catalysis—calculations and concepts. In Advances in Catalysis, Vol. 45 (eds Kuipers, H. P. C. E. & Gates, B. C.) 71–129 (Elsevier, 2000).
Bhattacharjee, S., Waghmare, U. V. & Lee, S.-C. An improved d-band model of the catalytic activity of magnetic transition metal surfaces. Sci. Rep. 6, 35916 (2016).
Luo, M. et al. PdMo bimetallene for oxygen reduction catalysis. Nature 574, 81–85 (2019).
Hulva, J. et al. Unraveling CO adsorption on model single-atom catalysts. Science 371, 375–379 (2021).
Aso, R. et al. Direct identification of the charge state in a single platinum nanoparticle on titanium oxide. Science 378, 202–206 (2022).
Liu, H.-Z. et al. Tailoring d-band center of high-valent metal-oxo species for pollutant removal via complete polymerization. Nat. Commun. 15, 2327 (2024).
Hensley, A. J. R., Wang, Y. & McEwen, J.-S. Adsorption of guaiacol on Fe (110) and Pd (111) from first principles. Surf. Sci. 648, 227–235 (2016).
Deng, Z., Zhang, X. H., Chan, K. C., Liu, L. & Li, T. Fe-based metallic glass catalyst with nanoporous surface for azo dye degradation. Chemosphere 174, 76–81 (2017).
Takahashi, Y. et al. In-situ X-ray diffraction of corrosion products formed on iron surfaces. Mater. Trans. 46, 637–642 (2005).
Ma, H. Y. et al. Influence of nitrate and chloride ions on the corrosion of iron. Corrosion 59, 1112–1119 (2003).
Keiser, J. T., Brown, C. W. & Heidersbach, R. H. The oxidation of Fe3O4 on iron and steel surfaces. Corrosion 38, 357–360 (1982).
Hohenberg, P. & Kohn, W. Inhomogeneous electron gas. Phys. Rev. 136, B864 (1964).
Kohn, W. & Sham, L. J. Self-consistent equations including exchange and correlation effects. Phys. Rev. 140, A1133 (1965).
Kresse, G. & Furthmüller, J. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set. Phys. Rev. B 54, 11169 (1996).
Kresse, G. & Furthmüller, J. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Comput. Mater. Sci. 6, 15–50 (1996).
Perdew, J. P., Burke, K. & Ernzerhof, M. Generalized gradient approximation made simple. Phys. Rev. Lett. 77, 3865–3868 (1996).
Dudarev, S. L., Botton, G. A., Savrasov, S. Y., Humphreys, C. J. & Sutton, A. P. Electron-energy-loss spectra and the structural stability of nickel oxide: an LSDA+U study. Phys. Rev. B 57, 1505–1509 (1998).
Maxisch, T., Zhou, F. & Ceder, G. Ab initio study of the migration of small polarons in olivine LixFePO4 and their association with lithium ions and vacancies. Phys. Rev. B 73, 104301 (2006).
Liao, P. & Carter, E. A. Ab initio DFT+ U predictions of tensile properties of iron oxides. J. Mater. Chem. 20, 6703–6719 (2010).
Grimme, S., Antony, J., Ehrlich, S. & Krieg, H. A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu. J. Chem. Phys. 132, 154104 (2010).
Henkelman, G., Uberuaga, B. P. & Jónsson, H. A climbing image nudged elastic band method for finding saddle points and minimum energy paths. J. Chem. Phys. 113, 9901–9904 (2000).
Henkelman, G. & Jónsson, H. Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points. J. Chem. Phys. 113, 9978–9985 (2000).
Si, J. et al. Fe-based metallic glasses as efficient oxygen scavengers. figshare. Dataset. https://doi.org/10.6084/m9.figshare.30964084 (2026).
Acknowledgements
We acknowledge the financial support from National Natural Science Foundation of China (No. 52271148), National Natural Science Foundation of China/Hong Kong Research Grants Council Joint Research Scheme (Project No. N_CityU151/23), Hong Kong JLFS-RGC-Joint Laboratory Funding Scheme (No. JLFS/E-102/24), Hong Kong Innovation and Technology Fund (ITF) (No. ITS/059/23MS), Guangdong Province Science and Technology Plan Project (No. 2023B1212120008). We thank Dr. Yang Chen from Peking University for his suggestion on simulation method, and thank Shiyanjia Lab (www.shiyanjia.com) for the DFT calculation service. J. Lu thanks the IMR-CityU Joint Laboratory of Nanomaterials & Nanomechanics and Guangdong-Hong Kong Joint Laboratory of Modern Surface Engineering Technology.
Author information
Authors and Affiliations
Contributions
J.S. conceived the idea. J.S., G.X., J. Lu, and K.Y. supervised the research and established the research route. J.S. and H. Liu. carried out the main the experiments. H. Luan designed the DFT calculations. Y.L. optimized the calculations. J.S., H. Luan, Y.S., G.X., and J. Lv analyzed the data. J.S., H. Luan, and Y.S. prepared the paper. All authors discussed the results. J.S. and H. Luan contributed equally to this work.
Corresponding authors
Ethics declarations
Competing interests
The authors declare no competing interests.
Peer review
Peer review information
Nature Communications thanks Baran Sarac and the other, anonymous, reviewer(s) for their contribution to the peer review of this work. A peer review file is available.
Additional information
Publisher’s note Springer Nature remains neutral with regard to jurisdictional claims in published maps and institutional affiliations.
Supplementary information
Rights and permissions
Open Access This article is licensed under a Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 International License, which permits any non-commercial use, sharing, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if you modified the licensed material. You do not have permission under this licence to share adapted material derived from this article or parts of it. The images or other third party material in this article are included in the article’s Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article’s Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by-nc-nd/4.0/.
About this article
Cite this article
Si, J., Luan, H., Liu, H. et al. Fe-based metallic glasses as efficient oxygen scavengers. Nat Commun (2026). https://doi.org/10.1038/s41467-026-71713-4
Received:
Accepted:
Published:
DOI: https://doi.org/10.1038/s41467-026-71713-4


