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关于钙钛矿型LuCrO磁性和磁结构的新见解。

New insights into the magnetism and magnetic structure of LuCrO perovskite.

作者信息

Muñoz Angel, Gainza Javier, Zhou Jian Shi, Martinez José Luis, Céspedes Eva, Fernández-Díaz Maria Teresa, Alonso José Antonio

机构信息

Universidad Carlos III, Avenida Universidad 30, E-28911, Leganés-Madrid, Spain.

Instituto de Ciencia de Materiales de Madrid, CSIC, Cantoblanco, Madrid, E-28049, Spain.

出版信息

Acta Crystallogr B Struct Sci Cryst Eng Mater. 2024 Oct 1;80(Pt 5):377-384. doi: 10.1107/S2052520624006711. Epub 2024 Sep 3.

DOI:10.1107/S2052520624006711
PMID:39234867
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC11457101/
Abstract

A polycrystalline sample LuCrO has been characterized by neutron powder diffraction (NPD) and magnetization measurements. Its crystal structure has been Rietveld refined from NPD data in space group Pnma; this perovskite contains strongly tilted CrO octahedra with extremely bent Cr-O-Cr superexchange angles of ∼142°. The NPD data show that below Néel temperature (T ≃ 131 K), the magnetic structure can be defined as an A-type antiferromagnetic arrangement of Cr magnetic moments, aligned along the b axis, with a canting along the c axis. A noticeable magnetostrictive effect is observed in the unit-cell parameters and volume upon cooling down across T. The AC magnetic susceptibility indicates the onset of magnetic ordering below 112.6 K; the magnetization isotherms below T show a nonlinear behaviour that is associated with the described canting of the Cr magnetic moments. From the Curie-Weiss law, the effective moment of the Cr sublattice is found to be μ = 3.55 μ (calculated 3.7 μ) while the Θ parameter yields a value of -155 K, indicating antiferromagnetic interactions. There is a conspicuous increase of T upon the application of external pressure, which must be due to shortening of the Cr-O bond length under compression that increases the orbital overlap integral.

摘要

通过中子粉末衍射(NPD)和磁化测量对多晶样品LuCrO进行了表征。其晶体结构已根据空间群Pnma中的NPD数据通过Rietveld精修;这种钙钛矿包含强烈倾斜的CrO八面体,其Cr - O - Cr超交换角极度弯曲,约为142°。NPD数据表明,在奈尔温度(T≃131 K)以下,磁结构可定义为Cr磁矩沿b轴排列、沿c轴有倾斜的A型反铁磁排列。在冷却至T以下时,在晶胞参数和体积中观察到明显的磁致伸缩效应。交流磁化率表明在112.6 K以下开始出现磁有序;T以下的磁化等温线显示出非线性行为,这与所描述的Cr磁矩倾斜有关。根据居里 - 外斯定律,发现Cr亚晶格的有效磁矩为μ = 3.55 μ(计算值为3.7 μ),而Θ参数的值为 - 155 K,表明存在反铁磁相互作用。施加外部压力时T显著升高,这一定是由于压缩下Cr - O键长缩短,增加了轨道重叠积分所致。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/414aaecec5a5/b-80-00377-fig8.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/dac449e1b5a1/b-80-00377-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/2f715dcb0734/b-80-00377-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/e0e22cd3beb9/b-80-00377-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/16795a09d79c/b-80-00377-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/96e7d6d1f2bd/b-80-00377-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/f65d4ef50aed/b-80-00377-fig6.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/7a275f9a9db0/b-80-00377-fig7.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/414aaecec5a5/b-80-00377-fig8.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/dac449e1b5a1/b-80-00377-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/2f715dcb0734/b-80-00377-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/e0e22cd3beb9/b-80-00377-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/16795a09d79c/b-80-00377-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/96e7d6d1f2bd/b-80-00377-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/f65d4ef50aed/b-80-00377-fig6.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/7a275f9a9db0/b-80-00377-fig7.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f383/11457101/414aaecec5a5/b-80-00377-fig8.jpg

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