In situ XAFS-XRD study of the Zr-Y2O3 interaction at extra-high temperatures.

IF 2.5 3区 物理与天体物理 Journal of Synchrotron Radiation Pub Date : 2024-07-01 Epub Date: 2024-05-31 DOI:10.1107/S1600577524003321
Ayumi Itoh, Satoru Matsuo, Kenta Yoshida, Kenji Konashi, Rikuto Ikuta, Keisuke Niino, Yuji Arita, Masaaki Kobata, Tatsuo Fukuda, Tohru Kobayashi, Hajime Tanida, Tsuyoshi Yaita
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Abstract

The in situ measurement technique for a metal/metal-oxide mixture at extra-high temperature above 2000 K has been desired in the field of nuclear safety engineering. In the present study, we succeeded in simultaneous XAFS-XRD measurements of the Zr oxidation [Zr + O → Zr(O) + ZrO2] up to 1952 K and ZrO2-Y2O3 reaction from 1952 to 2519 K. The chemical shift during Zr oxidation was observed in the absorption spectra around the Zr K-edge, and the interatomic cation-cation and cation-oxygen distances obtained by the fitting analysis of EXAFS during the Y2O3-ZrO2 reaction are explained. Also, the temperature dependency of the anharmonic effect was investigated by comparing the fitted second- and third-order cumulants with the theoretical ones in which the Morse potential was applied as an interatomic potential, giving a good explanation about the local structure dynamics. Finally, the applicability of the developed system to investigation of nuclear fuel materials, such as UO2-Zr, is discussed.

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超高温下 Zr-Y2O3 相互作用的原位 XAFS-XRD 研究。
核安全工程领域一直希望获得金属/金属氧化物混合物在 2000 K 以上超高温下的原位测量技术。在本研究中,我们成功地同时测量了 1952 K 以下的 Zr 氧化反应 [Zr + O → Zr(O) + ZrO2] 和 1952 K 至 2519 K 的 ZrO2-Y2O3 反应的 XAFS-XRD 值。在 Zr K-edge 附近的吸收光谱中观察到了 Zr 氧化过程中的化学位移,并解释了在 Y2O3-ZrO2 反应过程中通过 EXAFS 拟合分析得到的原子间阳离子-阳离子和阳离子-氧距离。此外,通过比较拟合的二阶和三阶累积量与应用莫尔斯电势作为原子间电势的理论累积量,研究了非谐波效应的温度依赖性,从而很好地解释了局部结构动力学。最后,讨论了所开发系统在研究 UO2-Zr 等核燃料材料方面的适用性。
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来源期刊
Journal of Synchrotron Radiation
Journal of Synchrotron Radiation INSTRUMENTS & INSTRUMENTATIONOPTICS&-OPTICS
CiteScore
5.60
自引率
12.00%
发文量
289
审稿时长
1 months
期刊介绍: Synchrotron radiation research is rapidly expanding with many new sources of radiation being created globally. Synchrotron radiation plays a leading role in pure science and in emerging technologies. The Journal of Synchrotron Radiation provides comprehensive coverage of the entire field of synchrotron radiation and free-electron laser research including instrumentation, theory, computing and scientific applications in areas such as biology, nanoscience and materials science. Rapid publication ensures an up-to-date information resource for scientists and engineers in the field.
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