Free Standard AU & NZ Shipping For All Book Orders Over $80!
Register      Login
Australian Journal of Chemistry Australian Journal of Chemistry Society
An international journal for chemical science
RESEARCH FRONT

Single-Crystal Neutron Diffraction Study of Superstructure Ordering and Domain Behaviour in Brownmillerite-Type Ca2Fe2O5

Josie E. Auckett A C , Andrew J. Studer B and Chris D. Ling A
+ Author Affiliations
- Author Affiliations

A School of Chemistry, The University of Sydney, Sydney 2006, Australia.

B Bragg Institute, ANSTO, PMB 1, Menai 2234, Australia.

C Corresponding author. Email: josie.auckett@sydney.edu.au

Australian Journal of Chemistry 67(12) 1824-1828 https://doi.org/10.1071/CH14358
Submitted: 4 June 2014  Accepted: 25 June 2014   Published: 15 September 2014

Abstract

We show that large single crystals of brownmillerite-type Ca2Fe2O5 can be grown using the floating-zone method under ambient pressure conditions, provided that the feed rods are pre-annealed to a very high density. Neutron diffraction data collected from these crystals show the emergence of a long-range ordered incommensurate phase at high temperature. The observation of this phase for the first time using neutrons proves that the incommensurate ordering of tetrahedral chains upon heating Ca2Fe2O5 is a truly long-range and bulk phenomenon. The results are used to compare and contrast the structures of Ca2Fe2O5 and Sr2Fe2O5, and are consistent with experimental observations of significantly higher oxide ionic conduction in the latter material.


References

[1]  I. A. Leonidov, M. V. Patrakeev, J. A. Bahteeva, K. V. Poholok, D. S. Filimonov, K. R. Poeppelmeier, V. L. Kozhevnikov, J. Solid State Chem. 2006, 179, 3045.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD28XovVSru7k%3D&md5=07c5175681d7e85537acd6f146fba23bCAS |

[2]  W. Paulus, H. Schober, S. Eibl, M. Johnson, T. Berthier, O. Hernandez, M. Ceretti, M. Plazanet, K. Conder, C. Lamberti, J. Am. Chem. Soc. 2008, 130, 16080.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD1cXhtlCgur%2FP&md5=617736ebf378051ca8fcf28568eb5c87CAS | 18986139PubMed |

[3]  D. Hirabayashi, T. Yoshikawa, K. Mochizuki, K. Suzuki, Y. Sakai, Catal. Lett. 2006, 110, 269.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD28XotlWjsLw%3D&md5=49c7bc9ddaff96f5844394d70c2cf614CAS |

[4]  M. Y. Hassaan, M. M. El-Desoky, M. Katada, T. Nishida, in The Role of Silicon Atoms inside the Brownmillerite Phase of Cement Clinker (Eds M. F. Thomas, J. M Williams, T. C. Gibb) 2002 (Springer: Dordrecht).

[5]  H. D’Hondt, A. M. Abakumov, J. Hadermann, A. S. Kalyuzhnaya, M. G. Rozova, E. V. Antipov, G. Van Tendeloo, Chem. Mater. 2008, 20, 7188.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD1cXhsVWgt77J&md5=a4dbb82da4d772cb3e9060c9c57ed274CAS |

[6]  H. Krüger, V. Kahlenberg, V. Petricek, F. Phillipp, W. Wertl, J. Solid State Chem. 2009, 182, 1515.
         | Crossref | GoogleScholarGoogle Scholar |

[7]  S. Lambert, H. Leligny, D. Grebille, D. Pelloquin, B. Raveau, Chem. Mater. 2002, 14, 1818.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD38Xit1WhurY%3D&md5=3c88e908c351de8e5d6fe495ddd788d6CAS |

[8]  T. Takeda, Y. Yamaguch, S. Tomiyosh, M. Fukase, M. Sugimoto, H. Watanabe, J. Phys. Soc. Jpn. 1968, 24, 446.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DyaF1cXot1CqsQ%3D%3D&md5=0d91b95aa023a47ff93283bef51485c8CAS |

[9]  P. Berastegui, S. G. Eriksson, S. Hull, Mater. Res. Bull. 1999, 34, 303.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DyaK1MXjtVGqtbw%3D&md5=8166e4ced0f210169f0560bda0d02ecbCAS |

[10]  J. E. Auckett, A. J. Studer, E. Pellegrini, J. Ollivier, M. R. Johnson, H. Schober, W. Miiller, C. D. Ling, Chem. Mater. 2013, 25, 3080.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BC3sXhtVCgsrrK&md5=8aa708211ce84d121163c93b136e9c43CAS |

[11]  H. Krüger, V. Kahlenberg, Acta Crystallogr. B 2005, 61, 656.
         | Crossref | GoogleScholarGoogle Scholar | 16306672PubMed |

[12]  A. Maljuk, J. Strempfer, C. T. Lin, J. Cryst. Growth 2003, 258, 435.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD3sXns1Wht7o%3D&md5=77ba64529119526729c3dbe3048ca522CAS |

[13]  P. Marchukov, R. Geick, C. Brotzeller, W. Treutmann, E. G. Rudashevsky, A. M. Balbashov, Phys. Rev. B 1993, 48, 13538.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DyaK2cXptlCrtA%3D%3D&md5=6edc2c2cc279a7718ceb77797d2be67aCAS |

[14]  Y. Yang, Z. Q. Cao, Y. S. Jiang, L. H. Liu, Y. B. Sun, Mater. Sci. Eng., B 2006, 132, 311.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD28XotV2htbs%3D&md5=2bcbf8ad814b7918bbfa07be337c534cCAS |

[15]  A. M. Abakumov, A. M. Alekseeva, M. G. Rozova, E. V. Antipov, O. I. Lebedev, G. Van Tendeloo, J. Solid State Chem. 2003, 174, 319.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD3sXmsVOmu7Y%3D&md5=07e870c3ad825567ba8613da02e64a0cCAS |

[16]  A. M. Abakumov, M. G. Rozova, B. P. Pavlyuk, M. V. Lobanov, E. V. Antipov, O. I. Lebedev, G. Van Tendeloo, D. V. Sheptyakov, A. M. Balagurov, F. Bouree, J. Solid State Chem. 2001, 158, 100.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD3MXis1Sqtbg%3D&md5=dc173fc6c816a8486208f4cb057b7268CAS |

[17]  J. E. Auckett, A. J. Studer, N. Sharma, C. D. Ling, Solid State Ionics 2012, 225, 432.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BC38XhsFChurfK&md5=71fcb3b16038efefddeee36a49158386CAS |

[18]  K. Momma, F. Izuma, J. Appl. Crystallogr. 2008, 41, 653.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD1cXlvFKgu78%3D&md5=85241e6d68655f874df46cea3255b234CAS |

[19]  B. Lazic, H. Kruger, V. Kahlenberg, J. Konzett, R. Kaindl, Acta Crystallogr. B 2008, 64, 417.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD1cXos12htbg%3D&md5=25b16c8a2e0d4439107523732a8df7aaCAS | 18641443PubMed |

[20]  H. Krüger, in Proceedings of the 35th Australian/New Zealand Annual Condensed Matter and Materials Meeting (Ed. A. P. Micolich), 1–4 February 2011; ISBN: 978–0-646–55969–8, p. 16.

[21]  H. D. Zhou, J. B. Goodenough, Solid State Sci. 2005, 7, 656.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DC%2BD2MXkvFKqsro%3D&md5=4611c1538ee321baaaecd4a75162dfeeCAS |

[22]  C. Brotzeller, R. Geick, P. Marchukov, E. G. Rudashevsky, A. M. Balbashov, Solid State Commun. 1992, 82, 923.
         | Crossref | GoogleScholarGoogle Scholar | 1:CAS:528:DyaK38Xks1WitLg%3D&md5=06b0150ff0f6ab9e00ccf6d9954a1947CAS |

[23]  A. J. Studer, M. E. Hagen, T. J. Noakes, Phys. B (Amsterdam, Neth.) 2006, 385–386, 1013.
         | Crossref | GoogleScholarGoogle Scholar |

[24]  V. Petříček, M. Dušek, L. Palatinus, Jana2006. The Crystallographic Computing System 03/05/2011 edn: 2006 (Institute of Physics: Praha, Czech Republic).